5-chloro-2-(ethylsulfanyl)-N-[(4-methylphenyl)methyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(ethylsulfanyl)-N-[(4-methylphenyl)methyl]pyrimidine-4-carboxamide
5-chloro-2-(ethylsulfanyl)-N-[(4-methylphenyl)methyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0124 |
| Compound Name: | 5-chloro-2-(ethylsulfanyl)-N-[(4-methylphenyl)methyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 321.83 |
| Molecular Formula: | C15 H16 Cl N3 O S |
| Smiles: | [H]N(Cc1ccc(C)cc1)C(c1c(cnc(n1)SCC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7526 |
| logD: | 3.7522 |
| logSw: | -3.9326 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.237 |
| InChI Key: | LDABKJOWDFTMGR-UHFFFAOYSA-N |