2-(methylsulfanyl)-4-phenyl-N-[3-(4-propylpiperazin-1-yl)propyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(methylsulfanyl)-4-phenyl-N-[3-(4-propylpiperazin-1-yl)propyl]pyrimidine-5-carboxamide
2-(methylsulfanyl)-4-phenyl-N-[3-(4-propylpiperazin-1-yl)propyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0530 |
| Compound Name: | 2-(methylsulfanyl)-4-phenyl-N-[3-(4-propylpiperazin-1-yl)propyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 413.58 |
| Molecular Formula: | C22 H31 N5 O S |
| Smiles: | CCCN1CCN(CCCNC(c2cnc(nc2c2ccccc2)SC)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.7832 |
| logD: | 1.8184 |
| logSw: | -3.3069 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.58 |
| InChI Key: | QALOBHXUJHABKS-UHFFFAOYSA-N |