N-[3-(methylsulfanyl)phenyl]-4-(6-phenylpyrimidin-4-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-4-(6-phenylpyrimidin-4-yl)piperazine-1-carboxamide
N-[3-(methylsulfanyl)phenyl]-4-(6-phenylpyrimidin-4-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | L262-0975 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-4-(6-phenylpyrimidin-4-yl)piperazine-1-carboxamide |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C22 H23 N5 O S |
| Smiles: | CSc1cccc(c1)NC(N1CCN(CC1)c1cc(c2ccccc2)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7207 |
| logD: | 4.7181 |
| logSw: | -4.4381 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.97 |
| InChI Key: | HFKWRMJJXRWPTB-UHFFFAOYSA-N |