N~2~-benzyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Chemical Structure Depiction of
N~2~-benzyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
N~2~-benzyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Compound characteristics
| Compound ID: | G786-0079 |
| Compound Name: | N~2~-benzyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C17 H23 N7 O2 |
| Smiles: | CCN1CCN(CC1)c1c(c(N)nc(NCc2ccccc2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5331 |
| logD: | 1.965 |
| logSw: | -2.6691 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.577 |
| InChI Key: | XDRSLNWBLRZPTQ-UHFFFAOYSA-N |