N-(4-cyanophenyl)-2-({6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-2-({6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
N-(4-cyanophenyl)-2-({6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | M179-4800 |
| Compound Name: | N-(4-cyanophenyl)-2-({6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 460.56 |
| Molecular Formula: | C24 H24 N6 O2 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)c1cc(ncn1)SCC(Nc1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.232 |
| logD: | 4.2316 |
| logSw: | -4.2388 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.063 |
| InChI Key: | CQQXTLNBIVCHAG-UHFFFAOYSA-N |