4-methoxy-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-methoxy-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide
4-methoxy-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | M070-0973 |
Compound Name: | 4-methoxy-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide |
Molecular Weight: | 443.56 |
Molecular Formula: | C20 H17 N3 O3 S3 |
Smiles: | COc1ccc(cc1)S(Nc1ccc2c(c1)sc(n2)SCc1cccnc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3466 |
logD: | 4.2559 |
logSw: | -4.1185 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.76 |
InChI Key: | ZJQTVMFJXDCDRA-UHFFFAOYSA-N |