{4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}{2-[(4-methylphenyl)sulfanyl]pyridin-3-yl}methanone
Chemical Structure Depiction of
{4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}{2-[(4-methylphenyl)sulfanyl]pyridin-3-yl}methanone
{4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}{2-[(4-methylphenyl)sulfanyl]pyridin-3-yl}methanone
Compound characteristics
| Compound ID: | V006-0467 |
| Compound Name: | {4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}{2-[(4-methylphenyl)sulfanyl]pyridin-3-yl}methanone |
| Molecular Weight: | 511.65 |
| Molecular Formula: | C29 H29 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1ccc(cc1)c1ccnc(n1)N1CCN(CC1)C(c1cccnc1Sc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8864 |
| logD: | 5.8864 |
| logSw: | -5.4092 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.837 |
| InChI Key: | IPRJYAWONPCVBX-UHFFFAOYSA-N |