2-(4-benzylpiperazin-1-yl)-5-nitro-N~4~-phenylpyrimidine-4,6-diamine
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-5-nitro-N~4~-phenylpyrimidine-4,6-diamine
2-(4-benzylpiperazin-1-yl)-5-nitro-N~4~-phenylpyrimidine-4,6-diamine
Compound characteristics
Compound ID: | G786-0200 |
Compound Name: | 2-(4-benzylpiperazin-1-yl)-5-nitro-N~4~-phenylpyrimidine-4,6-diamine |
Molecular Weight: | 405.46 |
Molecular Formula: | C21 H23 N7 O2 |
Smiles: | C1CN(CCN1Cc1ccccc1)c1nc(c(c(Nc2ccccc2)n1)[N+]([O-])=O)N |
Stereo: | ACHIRAL |
logP: | 3.7333 |
logD: | 3.6257 |
logSw: | -4.2579 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 87.758 |
InChI Key: | RVXNJUVKTIAOTR-UHFFFAOYSA-N |