N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(4-methylphenyl)methanesulfonamide
Chemical Structure Depiction of
N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(4-methylphenyl)methanesulfonamide
N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(4-methylphenyl)methanesulfonamide
Compound characteristics
| Compound ID: | M070-0280 |
| Compound Name: | N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(4-methylphenyl)methanesulfonamide |
| Molecular Weight: | 378.53 |
| Molecular Formula: | C17 H18 N2 O2 S3 |
| Smiles: | CCSc1nc2ccc(cc2s1)NS(Cc1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9509 |
| logD: | 4.7911 |
| logSw: | -4.681 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.597 |
| InChI Key: | VELLBUHPKSKOSG-UHFFFAOYSA-N |