2-(4-benzylpiperazin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine
2-(4-benzylpiperazin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | G786-0239 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine |
| Molecular Weight: | 423.45 |
| Molecular Formula: | C21 H22 F N7 O2 |
| Smiles: | C1CN(CCN1Cc1ccccc1)c1nc(c(c(Nc2cccc(c2)F)n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 4.0785 |
| logD: | 3.9708 |
| logSw: | -4.4347 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.758 |
| InChI Key: | QNZLZTRKHWAOPI-UHFFFAOYSA-N |