N~4~-(4-chlorophenyl)-N~2~-(2-methylpropyl)-5-nitropyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~4~-(4-chlorophenyl)-N~2~-(2-methylpropyl)-5-nitropyrimidine-2,4,6-triamine
N~4~-(4-chlorophenyl)-N~2~-(2-methylpropyl)-5-nitropyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0046 |
| Compound Name: | N~4~-(4-chlorophenyl)-N~2~-(2-methylpropyl)-5-nitropyrimidine-2,4,6-triamine |
| Molecular Weight: | 336.78 |
| Molecular Formula: | C14 H17 Cl N6 O2 |
| Smiles: | CC(C)CNc1nc(c(c(Nc2ccc(cc2)[Cl])n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 4.0944 |
| logD: | 4.0943 |
| logSw: | -4.4569 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 93.478 |
| InChI Key: | HREJXNGDZWTOQD-UHFFFAOYSA-N |