2-(4-benzylpiperazin-1-yl)-6-(3,5-dimethylpiperidin-1-yl)-5-nitropyrimidin-4-amine
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-6-(3,5-dimethylpiperidin-1-yl)-5-nitropyrimidin-4-amine
2-(4-benzylpiperazin-1-yl)-6-(3,5-dimethylpiperidin-1-yl)-5-nitropyrimidin-4-amine
Compound characteristics
| Compound ID: | G786-0104 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-6-(3,5-dimethylpiperidin-1-yl)-5-nitropyrimidin-4-amine |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C22 H31 N7 O2 |
| Smiles: | CC1CC(C)CN(C1)c1c(c(N)nc(n1)N1CCN(CC1)Cc1ccccc1)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1545 |
| logD: | 4.0468 |
| logSw: | -4.3096 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.458 |
| InChI Key: | BJMIJVCIZPEMOH-UHFFFAOYSA-N |