N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0509 |
| Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C26 H31 N5 O2 S |
| Smiles: | COc1ccc(cc1)N1CCN(CCCNC(c2cnc(nc2c2ccccc2)SC)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.8922 |
| logD: | 3.3483 |
| logSw: | -3.8491 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.594 |
| InChI Key: | QYZDASURNFWUQX-UHFFFAOYSA-N |