propan-2-yl 5-cyano-2-methyl-6-sulfanyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate--morpholine (1/1)
Chemical Structure Depiction of
propan-2-yl 5-cyano-2-methyl-6-sulfanyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate--morpholine (1/1)
propan-2-yl 5-cyano-2-methyl-6-sulfanyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate--morpholine (1/1)
Compound characteristics
| Compound ID: | 8009-9359 |
| Compound Name: | propan-2-yl 5-cyano-2-methyl-6-sulfanyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate--morpholine (1/1) |
| Molecular Weight: | 407.55 |
| Molecular Formula: | C15 H16 N2 O2 S2 |
| Salt: | O(CH2CH2)2NH |
| Smiles: | CC(C)OC(C1C(C(C#N)=C(NC=1C)S)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0231 |
| logD: | -1.3035 |
| logSw: | -3.2597 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.945 |
| InChI Key: | KFAJMCXGWZHVBF-ZDUSSCGKSA-N |