5-chloro-N-(2,5-dimethylphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(2,5-dimethylphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-(2,5-dimethylphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0081 |
| Compound Name: | 5-chloro-N-(2,5-dimethylphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 321.83 |
| Molecular Formula: | C15 H16 Cl N3 O S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCC)[Cl])=O)c1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 3.9773 |
| logD: | 3.9761 |
| logSw: | -4.1544 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.217 |
| InChI Key: | REYBIZUOCFHVNB-UHFFFAOYSA-N |