methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8019-5274 |
| Compound Name: | methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C23 H23 N3 O4 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCc1cccnc1)c1ccc(c(c1)OC)OC)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8274 |
| logD: | 0.2001 |
| logSw: | -3.0859 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.783 |
| InChI Key: | HTSOHOWYTNAQPP-NRFANRHFSA-N |