3-[(2-hydroxyethyl)sulfanyl]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-[(2-hydroxyethyl)sulfanyl]-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-[(2-hydroxyethyl)sulfanyl]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
Compound ID: | 8002-8693 |
Compound Name: | 3-[(2-hydroxyethyl)sulfanyl]-1H-1lambda~6~,2-benzothiazole-1,1-dione |
Molecular Weight: | 243.3 |
Molecular Formula: | C9 H9 N O3 S2 |
Smiles: | C(CSC1c2ccccc2S(N=1)(=O)=O)O |
Stereo: | ACHIRAL |
logP: | 0.3493 |
logD: | 0.3493 |
logSw: | -2.2026 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.435 |
InChI Key: | QBKCXBCNDNFBCM-UHFFFAOYSA-N |