ethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-sulfanylidene-1,6-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-sulfanylidene-1,6-dihydropyridine-3-carboxylate
ethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-sulfanylidene-1,6-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8007-1076 |
| Compound Name: | ethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-sulfanylidene-1,6-dihydropyridine-3-carboxylate |
| Molecular Weight: | 332.81 |
| Molecular Formula: | C16 H13 Cl N2 O2 S |
| Smiles: | CCOC(C1C(=C(C#N)C(NC=1C)=S)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8108 |
| logD: | -2.224 |
| logSw: | -4.5227 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.224 |
| InChI Key: | NPAWEFBSTWSMNE-UHFFFAOYSA-N |