5-chloro-N-[(4-methoxyphenyl)methyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[(4-methoxyphenyl)methyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-[(4-methoxyphenyl)methyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0426 |
| Compound Name: | 5-chloro-N-[(4-methoxyphenyl)methyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 351.85 |
| Molecular Formula: | C16 H18 Cl N3 O2 S |
| Smiles: | [H]N(Cc1ccc(cc1)OC)C(c1c(cnc(n1)SCCC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6448 |
| logD: | 3.6448 |
| logSw: | -3.8468 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.781 |
| InChI Key: | NHEMNRZZEFPPEP-UHFFFAOYSA-N |