2-(azepan-1-yl)-6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-amine
Chemical Structure Depiction of
2-(azepan-1-yl)-6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-amine
2-(azepan-1-yl)-6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-amine
Compound characteristics
| Compound ID: | G786-0062 |
| Compound Name: | 2-(azepan-1-yl)-6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-amine |
| Molecular Weight: | 411.51 |
| Molecular Formula: | C21 H29 N7 O2 |
| Smiles: | C1CCCN(CC1)c1nc(c(c(n1)N1CCN(CC1)Cc1ccccc1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 3.9926 |
| logD: | 3.9152 |
| logSw: | -4.3154 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.922 |
| InChI Key: | UEEUPVDZIKDTER-UHFFFAOYSA-N |