2-(azepan-1-yl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine
Chemical Structure Depiction of
2-(azepan-1-yl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine
2-(azepan-1-yl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine
Compound characteristics
Compound ID: | G786-0094 |
Compound Name: | 2-(azepan-1-yl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine |
Molecular Weight: | 335.41 |
Molecular Formula: | C15 H25 N7 O2 |
Smiles: | CN1CCN(CC1)c1c(c(N)nc(n1)N1CCCCCC1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.4944 |
logD: | 2.0328 |
logSw: | -2.3124 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.858 |
InChI Key: | UORAIWBWIDQJDL-UHFFFAOYSA-N |