N-(4-chlorophenyl)-2-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carboxamide
N-(4-chlorophenyl)-2-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | D276-0209 |
| Compound Name: | N-(4-chlorophenyl)-2-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carboxamide |
| Molecular Weight: | 453.99 |
| Molecular Formula: | C24 H24 Cl N3 O2 S |
| Smiles: | Cc1ccc(c(C)c1)NC(CSc1c(C(Nc2ccc(cc2)[Cl])=O)c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6223 |
| logD: | 5.5801 |
| logSw: | -6.1384 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.063 |
| InChI Key: | KHNOLQWQQWBWIY-UHFFFAOYSA-N |