| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | Yes |
Popular Name: 2H-1,4-benzothiazin-3(4H)-one 2H-1,4-benzothiazin-3(4H)-one
Find On: PubMed — Wikipedia — Google
CAS Numbers: 5325-20-2 , [5325-20-2]
(2H),1,4-Benzothiazin-3(4H)-one
(2H)1,4-Benzothiazin-3(4H)-one
(2H)1,4-Benzothiazin-3(4H)-one, 99%
2,4-Dihydro-1,4-benzothiazin-3-one
2H-1,4-Benzothiazine-3(4H)-One [5325-20-2]
2H-1,4-BENZOTHIAZINE-3(4H)-ONE; [5325-20-2]
2H-BENZO[B][1,4]THIAZIN-3(4H)-ONE
| 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) | 1.36 | 3.54 | -6.21 | 1 | 2 | 0 | 29 | 165.217 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 174 - 175 | MolMall (formerly Molecular Diversity Preservation International) |
| MP | 176 - 178 | Enamine Building Blocks |
| MP | 176-178 °C(lit.) | Indofine |
| Melting_Point | 176-178? | Alfa-Aesar |
| Melting_Point | 176-178° | Alfa-Aesar |
| melting_point | 177 - 178 | KeyOrganics |
| MP | 178.7-180.3o C | Indofine |
| MP | 179 - 181 | Enamine Building Blocks |
| MP | 179...181 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| biological_use | Fungicide | ZereneX Building Blocks |
| SOLUBILITY | Soluble in Chloroform | Indofine |
| mechanism | TNF Agonist-Alpha; Nitric Oxide synthase stimulator | ZereneX Building Blocks |
