N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Chemical Structure Depiction of
N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Compound characteristics
| Compound ID: | L904-0753 |
| Compound Name: | N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide |
| Molecular Weight: | 485.97 |
| Molecular Formula: | C22 H16 Cl N3 O4 S2 |
| Smiles: | Cc1ccc2c(c1)sc(c1ccc(cc1[Cl])NS(c1ccc3c(c1)OC(N3C)=O)(=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.3287 |
| logD: | 5.3091 |
| logSw: | -5.93 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.203 |
| InChI Key: | KUBYLIBKJHWPPH-UHFFFAOYSA-N |