N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine
N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine
Compound characteristics
| Compound ID: | D278-0008 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine |
| Molecular Weight: | 279.79 |
| Molecular Formula: | C13 H14 Cl N3 S |
| Smiles: | Cc1cc(NCc2ccc(cc2)[Cl])nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 3.6305 |
| logD: | 3.6216 |
| logSw: | -3.9759 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.1397 |
| InChI Key: | XQFGDXQKKWPKPE-UHFFFAOYSA-N |