N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)benzenesulfonamide
Chemical Structure Depiction of
N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)benzenesulfonamide
N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)benzenesulfonamide
Compound characteristics
| Compound ID: | M004-0243 |
| Compound Name: | N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)benzenesulfonamide |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C22 H20 N4 O4 S2 |
| Smiles: | [H]c1cc2c(cc1NC(NCc1cccc(c1)OC)=O)nc(NS(c1ccccc1)(=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.3825 |
| logD: | 3.9815 |
| logSw: | -4.3925 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.818 |
| InChI Key: | YFAQPIPQXOWKFR-UHFFFAOYSA-N |