2-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}pyrimidine-5-carboxamide
2-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | M814-0115 |
| Compound Name: | 2-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}pyrimidine-5-carboxamide |
| Molecular Weight: | 289.35 |
| Molecular Formula: | C14 H15 N3 O2 S |
| Smiles: | COc1ncc(cn1)C(NCc1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0709 |
| logD: | 2.0709 |
| logSw: | -2.4846 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.611 |
| InChI Key: | RRLJNYUINXZRBZ-UHFFFAOYSA-N |