5-chloro-2-(ethylsulfanyl)-N-(4-methylphenyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(ethylsulfanyl)-N-(4-methylphenyl)pyrimidine-4-carboxamide
5-chloro-2-(ethylsulfanyl)-N-(4-methylphenyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0066 |
| Compound Name: | 5-chloro-2-(ethylsulfanyl)-N-(4-methylphenyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 307.8 |
| Molecular Formula: | C14 H14 Cl N3 O S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCC)[Cl])=O)c1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1613 |
| logD: | 4.1599 |
| logSw: | -4.2046 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.915 |
| InChI Key: | DMFBTSKFWOIUMI-UHFFFAOYSA-N |