N~2~-[(furan-2-yl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Chemical Structure Depiction of
N~2~-[(furan-2-yl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
N~2~-[(furan-2-yl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Compound characteristics
| Compound ID: | G786-0092 |
| Compound Name: | N~2~-[(furan-2-yl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine |
| Molecular Weight: | 333.35 |
| Molecular Formula: | C14 H19 N7 O3 |
| Smiles: | CN1CCN(CC1)c1c(c(N)nc(NCc2ccco2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.939 |
| logD: | 1.4775 |
| logSw: | -2.291 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.266 |
| InChI Key: | PQLKLZBORRMNKP-UHFFFAOYSA-N |