N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | F260-0026 |
| Compound Name: | N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 467.52 |
| Molecular Formula: | C22 H17 N3 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(Nc1nc2ccc(cc2s1)NC(c1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.883 |
| logD: | 4.482 |
| logSw: | -4.6408 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.856 |
| InChI Key: | FRUSKVXVYSKAMU-UHFFFAOYSA-N |