N-{[4-(dimethylamino)phenyl]methyl}-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
N-{[4-(dimethylamino)phenyl]methyl}-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | M023-0265 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide |
| Molecular Weight: | 490.66 |
| Molecular Formula: | C22 H26 N4 O3 S3 |
| Smiles: | Cc1c(C(N2CCCC2)=O)sc(c2cc(sc2)S(NCc2ccc(cc2)N(C)C)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0528 |
| logD: | 4.0391 |
| logSw: | -4.0313 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.145 |
| InChI Key: | GQBVBVHQPRWPEC-UHFFFAOYSA-N |