UCSF

ZINC01530598

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 27 No

Popular Name: Chlorotrianisene Chlorotrianisene

Find On: PubMed — Wikipedia — Google

CAS Number: 569-57-3

Other Names:

1,1',1''-(1-Chloro-1-ethenyl-2-ylidene)-tris(4-methoxybenzene)

1,1',1''-(1-Chloro-1-ethenyl-2-ylidene)-tris(4-methoxybenzene); 1,1',1''-(2-chloroethene-1,1,2-triyl)tris(4-methoxybenzene); 1,1',1''-(2-chloroethene-1,1,2-triyl)tris[4-(methyloxy)benzene]; Anisene; BRN 1891845; Benzene, 1,1',1''-(1-chloro-1-ethenyl-2-yli

1,1',1''-(2-chloroethene-1,1,2-triyl)tris(4-methoxybenzene)

1,1',1''-(2-chloroethene-1,1,2-triyl)tris[4-(methyloxy)benzene]

1-[1-chloro-2,2-bis(4-methoxyphenyl)ethenyl]-4-methoxybenzene

4-06-00-07650 (Beilstein Handbook Reference)

569-57-3

569-57-3; Chlorotrianisene (INN); D00269; TACE (TN)

569-57-3; Chlorotrianisene; Prestwick_22

AB00051941

AC-12512

AC1L1X1E

AC1Q3FDW

Anisene

BAN

Benzene, 1,1',1''-(1-chloro-1-ethenyl-2-ylidene)tris(4-methoxy)-

Benzene, 1,1',1''-(1-chloro-1-ethenyl-2-ylidene)tris(4-methoxy-

Benzene, 1,1',1''-(1-chloro-1-ethenyl-2-ylidene)tris[4-methoxy-

Benzene, 1,1',1'-(1-chloro-1-ethenyl-2-ylidene)tris(4-methoxy)-

BPBio1_000852

BRN 1891845

BSPBio_000774

BSPBio_002005

C23H21ClO3

C7128_SIGMA

CAS-569-57-3

CCRIS 4769

CHEBI:3641

CHEMBL1200761

Chloortrianisestrol

Chloortrianisestrol; Chlorestrolo; Chlorotrianisine; Chlorotrianizen; Chlortrianisen; Chlortrianisestrol; Chlortrianisoestrolum; Chlortrianizen

Chloortrianisestrol;Chlorestrolo;Chlorotrianisenum [INN-Latin];Chlorotrianisine;Chlorotrianizen;Chlortrianisen;Chlortrianisene;Chlortrianisenum;Chlortrianisestrol;Chlortrianisoestrolum;Chlortrianizen;Clorotrianiseno [INN-Spanish]

Chlorestrolo

Chlorotrianisene (BAN

Chlorotrianisene (FDA

Chlorotrianisene (INN)

Chlorotrianisene [BAN:INN]

Chlorotrianisene [INN:BAN]

Chlorotrianisene [Nonsteroidal oestrogens]

chlorotrianisene; chlorotrianisenum; clorotrianiseno

Chlorotrianisenum

Chlorotrianisenum [INN-Latin]

chlorotrianisestrol

Chlorotrianisine

Chlorotrianizen

Chlorotris(p-methoxyphenyl)ethylene

Chlorotrisin

Chlortrianisen

Chlortrianisene

Chlortrianisenum

Chlortrianisestrol

Chlortrianisoestrolum

Chlortrianizen

CID11289

Clorestrolo

Clorotrianisene

Clorotrianisene [DCIT]

Clorotrianiseno

Clorotrianiseno [INN-Spanish]

Clorotrisin

CTA

D00269

DAP001012

DB00269

EINECS 209-318-6

Ethylene, chlorotris(p-methoxyphenyl)-

FDA

HMS1570G16

HMS1920K17

HMS2091C20

Hormonisene

HSDB 3302

INN

INN)

KBio2_000596

KBio2_003164

KBio2_005732

KBio3_001225

KBioGR_001568

KBioSS_000596

Khlortrianizen

LS-226

Merbentul

Metace

MFCD00048044

MLS000028625

MLS002415722

MolPort-001-783-515

MolPort-005-933-845

NCGC00016511-01

NCGC00091333-01

NCGC00091333-02

NCGC00091333-03

NSC-10108

NSC10108

Prestwick0_000757

Prestwick1_000757

Prestwick2_000757

Prestwick3_000757

Prestwick_22

Rianil

SMR000058658

SPBio_000887

SPBio_002713

SPECTRUM1500181

Spectrum2_000704

Spectrum3_000343

Spectrum4_000954

Spectrum5_000711

Spectrum_000136

Tace

Tace (pharmaceutical)

TACE (TN)

Tace-Fn

Tri-p-anisylchloroethylene

Triagen

Trianisestrol

Tris(p-methoxyphenyl)chloroethylene

UNII-6V5034L121

USP

USP)

WLN: 1OR DYGUYR DO1&R DO1

ZINC01530598

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) 5.86 11.2 -6.66 0 3 0 28 380.871 6 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.99e-04 g/l DrugBank-approved
Patent Database Links EP1938798; US2005130980; US2006014755; US2006030555; US2006040958; US2006041131; US2006069103; US2006094706; US2006106023; US2006122389; US2006128725; US2006173016; US2006173017; US2006178371; US2006281778; US2007225270; WO2005077954; WO2005082908; WO2006 ChEBI
Therapy estrogen SMDC MicroSource

Activity (Go SEA)

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