N~4~-benzyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~4~-benzyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
N~4~-benzyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0249 |
| Compound Name: | N~4~-benzyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine |
| Molecular Weight: | 288.31 |
| Molecular Formula: | C13 H16 N6 O2 |
| Smiles: | CN(C)c1nc(c(c(NCc2ccccc2)n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 2.0904 |
| logD: | 2.09 |
| logSw: | -2.4759 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.892 |
| InChI Key: | XQOROTLNRPWWEL-UHFFFAOYSA-N |