N~4~-benzyl-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine
Chemical Structure Depiction of
N~4~-benzyl-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine
N~4~-benzyl-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | G786-0250 |
| Compound Name: | N~4~-benzyl-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine |
| Molecular Weight: | 314.34 |
| Molecular Formula: | C15 H18 N6 O2 |
| Smiles: | C1CCN(C1)c1nc(c(c(NCc2ccccc2)n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 2.8459 |
| logD: | 2.8459 |
| logSw: | -3.2666 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.906 |
| InChI Key: | FBIUNZMRBKBETC-UHFFFAOYSA-N |