UCSF

ZINC00897222

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2005 27 Yes

Popular Name: Bendroflumethiazide Bendroflumethiazide

Find On: PubMed — Wikipedia — Google

CAS Number: 73-48-3

Other Names:

(+-)-3-Benzyl-3,4-dihydro-6-(trifluoromethyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

(+-)-3-Benzyl-3,4-dihydro-6-(trifluoromethyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide; 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 3,4-dihydro-3-(phenylmethyl)-6-(trifluoromethyl)-, 1,1-dioxide; 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 3,4-dihydr

(S)-bendroflumethiazide

+--3-benzyl-3,4-dihydro-6-(trifluoromethyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

+--3-benzyl-3,4-dihydro-6-(trifluoromethyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide; 6-trifluoromethyl-3-benzyl-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine 1,1-dioxide; Bendroflumethiazide; bendrofluazide; benzhydroflumethiazide

thiazide

2H-1,2,4-Benzothiadiazine-7-sulfonamide, 3,4-dihydro-3-(phenylmethyl)-6-(trifluoromethyl)-, 1,1-dioxide

2H-1,2,4-Benzothiadiazine-7-sulfonamide, 3,4-dihydro-3-(phenylmethyl)-6-(trifluoromethyl)-, 1,1-dioxide, (+-)-

2H-1,2,4-Benzothiadiazine-7-sulfonamide, 3-benzyl-3,4-dihydro-6-(trifluoromethyl)-, 1,1-dioxide

2H-1,2,4-Benzothiadiazine-7-sulfonamide, 3-benzyl-3,4-dihydro-6-(trifluoromethyl)-,1,1-dioxide

3,4-Dihydro-3-(phenylmethyl)-6-(trifluoromethyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

3-(phenylmethyl)-6-(trifluoromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

3-Benzyl-3,4-dihydro-6-(trifluoromethyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

3-Benzyl-6-(trifluoromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

3-Benzyl-6-trifluoromethyl-7-sulfamoyl-3,4-dihydro-1,2,4-benzothiadiazine, 1,1-dioxide

3-Benzyl-6-trifluoromethyl-7-sulfamoyl-3,4-dihydro-2H-1,2,4-benzothiadiazine 1,1-dioxide

4-27-00-08041 (Beilstein Handbook Reference)

6-trifluoromethyl-3-benzyl-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine 1,1-dioxide

6-Trifluoromethyl-3-benzyl-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine, 1,1-dioxide

73-48-3

73-48-3; Bendroflumethiazide (JAN/USP/INN); D00650; Naturetin (TN)

73-48-3; Bendroflumethiazide; C07758

73-48-3; Bendroflumethiazide; Prestwick_992

96782-79-5

AB00052315

AC1L1DEI

Aprinox

B5775_FLUKA

B5775_SIGMA

Be 724-A

Bendrofluazide

Bendrofluazide (BAN); Bendroflumethiazide (FDA

Bendrofluazide; Bendroflumethiazide; CPD000058802; SAM002264598

Bendrofluazide; CPD000058802; SAM002264598

Bendrofluazide;Bendroflumethazide;Bendroflumethiazidum [INN-Latin];Bendroflumetiazida [INN-Spanish];Bendrofumethiazide;Benzhydroflumethiazide;Benzydroflumethiazide;Benzylhydroflumethiazide;BHFT

Bendroflumethazide

Bendroflumethazide; Bendroflumethiazidum [INN-Latin]; Bendroflumetiazida [INN-Spanish]; Bendrofumethiazide; Bendrofluazide; Benzhydroflumethiazide; Benzydroflumethiazide; Benzylhydroflumethiazide; BHFT

Bendroflumethazide;Bendroflumethiazidum [INN-Latin];Bendroflumetiazida [INN-Spanish];Bendrofumethiazide;Bendrofluazide;Benzhydroflumethiazide;Benzydroflumethiazide;Benzylhydroflumethiazide;BHFT

Bendroflumethiazide (JAN/USP/INN)

Bendroflumethiazide [USP]

bendroflumethiazide; bendroflumethiazidum; bendroflumetiazida

BENDROFLUMETHIAZIDE; NADOLOL; C17H27NO4.C15H14F3N3O4S2; CORZIDE; LS-178520

Bendroflumethiazidum

Bendroflumethiazidum [INN-Latin]

Bendroflumetiazida

Bendroflumetiazida [INN-Spanish]

Bendroflumetiazide

Bendroflumetiazide [DCIT]

Bendrofumethiazide

Bentride

Benuron

Benzhydroflumethiazide

Benzy-Rodiuran

Benzydroflumethiazide

Benzylhydroflumethiazide

Benzylrodiuran

Berkozide

BHFT

BL H368

BPBio1_000978

BRD-A80017228-001-05-9

Bristuric

Bristuron

BRN 0373316

BSPBio_000888

BSPBio_003036

C07758

C15H14F3N3O4S2

Centyl

CHEBI:3013

CHEBI:615239

CHEMBL1684

CID2315

Corzide

CPD000058802

D00650

DAP000188

DB00436

DivK1c_000274

EINECS 200-800-1

EU-0009291

Flumersil

Flumesil

FT 8

FT 81

HMS1570M10

HMS1922E15

HMS2092J16

HMS500N16

HSDB 3293

IDI1_000274

INN

Intolex

JAN

KBio1_000274

KBio2_001866

KBio2_004434

KBio2_007002

KBio3_002536

KBioGR_001188

KBioSS_001866

Livesan

LS-40431

MFCD00078963

MLS000028558

MLS001076062

MolPort-003-666-443

Naigaril

Nateretin

Naturetin

Naturetin (TN)

Naturetin-10

Naturetin-2.5

Naturetin-5

Naturine

NCGC00089729-02

NCGC00089729-03

nchembio747-comp20

Neo-Naclex

Neo-Rontyl

Niagaril

Nikion

NINDS_000274

Orsile

Pluryl

Pluryle

Plusuril

Poliuron

Prestwick0_000784

Prestwick1_000784

Prestwick2_000784

Prestwick3_000784

Prestwick_992

Rautrax N

Rauzide

Relan Beta

Repicin

Salural

Salures

SAM002264598

Sinesalin

SMR000058802

Sodiuretic

SPBio_001308

SPBio_002827

SPECTRUM1503104

Spectrum2_001524

Spectrum3_001558

Spectrum4_000774

Spectrum5_001016

Spectrum_001386

ST51014919

Thiazidico

UNII-5Q52X6ICJI

UNM000000601501

Urlea

USP)

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.95 -0.45 -18.74 4 7 0 118 421.422 4 ↓
Mid Mid (pH 6-8) 1.95 -0.86 -44.53 3 7 -1 120 420.414 4 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.14e-01 g/l DrugBank-approved
Indications antihypertensive KeyOrganics Bioactives
Therapy diuretic SMDC Iconix
therap diuretic, antihypertensive MicroSource Spectrum
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : LightBiologicals; NCC_SUPPLIER_STRUCTURE_ID : B-8008 NIH Clinical Collection via PubChem
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: LightBiologicals; SUPPLIER_STRUCTURE_ID: B-8008 NIH Clinical Collection via PubChem

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )