N-(5-chloro-2-methoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-(5-chloro-2-methoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0120 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 323.8 |
| Molecular Formula: | C14 H14 Cl N3 O2 S |
| Smiles: | Cc1c(cnc(n1)SC)C(Nc1cc(ccc1OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0763 |
| logD: | 2.3658 |
| logSw: | -3.5415 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.654 |
| InChI Key: | DCIWGXWMSSEVHF-UHFFFAOYSA-N |