6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenylpyridine-3-carboxamide
Chemical Structure Depiction of
6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenylpyridine-3-carboxamide
6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4552-5650 |
| Compound Name: | 6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenylpyridine-3-carboxamide |
| Molecular Weight: | 573.07 |
| Molecular Formula: | C30 H25 Cl N4 O4 S |
| Smiles: | Cc1c(C(Nc2ccccc2)=O)c(c2ccc(c(c2)OC)OC)c(C#N)c(n1)SCC(Nc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8644 |
| logD: | 5.8639 |
| logSw: | -5.995 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.577 |
| InChI Key: | DIOMCXHLUQSCCB-UHFFFAOYSA-N |