N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | G795-0013 |
| Compound Name: | N-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide |
| Molecular Weight: | 431.47 |
| Molecular Formula: | C23 H17 N3 O4 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccc(cc1)NC(c1c2ccccc2sn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1327 |
| logD: | 4.1326 |
| logSw: | -4.4553 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.849 |
| InChI Key: | MPNZUYRQSXUYSB-UHFFFAOYSA-N |