4-{[4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]amino}-N-(4,6-dimethylpyrimidin-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-{[4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]amino}-N-(4,6-dimethylpyrimidin-2-yl)benzene-1-sulfonamide
4-{[4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]amino}-N-(4,6-dimethylpyrimidin-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4052-1388 |
| Compound Name: | 4-{[4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]amino}-N-(4,6-dimethylpyrimidin-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 512.05 |
| Molecular Formula: | C24 H22 Cl N5 O2 S2 |
| Smiles: | Cc1cc(C)nc(NS(c2ccc(cc2)/N=C2\N(CC=C)C(=CS2)c2ccc(cc2)[Cl])(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0885 |
| logD: | 3.882 |
| logSw: | -5.4737 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.521 |
| InChI Key: | VDUIMSYELFBSAE-UHFFFAOYSA-N |