4-methyl-N-[3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzene-1-sulfonamide
Chemical Structure Depiction of
4-methyl-N-[3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzene-1-sulfonamide
4-methyl-N-[3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V029-1837 |
| Compound Name: | 4-methyl-N-[3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzene-1-sulfonamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C22 H23 N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(/N=C1/N(Cc2cccc(c2)C(N2CCCC2)=O)C=CS1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0493 |
| logD: | 3.0493 |
| logSw: | -3.3307 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.186 |
| InChI Key: | JTFHPGLUFNIDOX-FCQUAONHSA-N |