N-[(4-methylphenyl)methyl]-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
N-[(4-methylphenyl)methyl]-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | M023-0068 |
| Compound Name: | N-[(4-methylphenyl)methyl]-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide |
| Molecular Weight: | 461.62 |
| Molecular Formula: | C21 H23 N3 O3 S3 |
| Smiles: | Cc1ccc(CNS(c2cc(cs2)c2nc(C)c(C(N3CCCC3)=O)s2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3861 |
| logD: | 4.3837 |
| logSw: | -4.1792 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.34 |
| InChI Key: | CSHAQHFLOIELHX-UHFFFAOYSA-N |