4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide--4-methylmorpholine (1/1)
Chemical Structure Depiction of
4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide--4-methylmorpholine (1/1)
4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide--4-methylmorpholine (1/1)
Compound characteristics
| Compound ID: | 8007-4237 |
| Compound Name: | 4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide--4-methylmorpholine (1/1) |
| Molecular Weight: | 483.03 |
| Molecular Formula: | C20 H16 Cl N3 O S |
| Salt: | O(CH2CH2)2NCH3 |
| Smiles: | CC1=C(C(C(C#N)=C(N1)S)c1ccccc1[Cl])C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1069 |
| logD: | -0.2197 |
| logSw: | -4.3228 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 50.585 |
| InChI Key: | YDUAHOQCNLLCFR-GOSISDBHSA-N |