6-(4-ethylpiperazin-1-yl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine
Chemical Structure Depiction of
6-(4-ethylpiperazin-1-yl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine
6-(4-ethylpiperazin-1-yl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine
Compound characteristics
| Compound ID: | G786-0081 |
| Compound Name: | 6-(4-ethylpiperazin-1-yl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine |
| Molecular Weight: | 337.42 |
| Molecular Formula: | C15 H27 N7 O2 |
| Smiles: | CCN1CCN(CC1)c1c(c(N)nc(NCCC(C)C)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7967 |
| logD: | 2.2285 |
| logSw: | -3.3105 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.69 |
| InChI Key: | BATUWUUVTQUAKJ-UHFFFAOYSA-N |