N~1~-[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]-N~4~-phenylbenzene-1,4-diamine
Chemical Structure Depiction of
N~1~-[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]-N~4~-phenylbenzene-1,4-diamine
N~1~-[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]-N~4~-phenylbenzene-1,4-diamine
Compound characteristics
| Compound ID: | D278-0530 |
| Compound Name: | N~1~-[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]-N~4~-phenylbenzene-1,4-diamine |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C18 H18 N4 S |
| Smiles: | Cc1cc(Nc2ccc(cc2)Nc2ccccc2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.8524 |
| logD: | 4.8384 |
| logSw: | -4.6632 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.73 |
| InChI Key: | RBMQQMVYNLFDBB-UHFFFAOYSA-N |