N~4~-(3-chlorophenyl)-N~2~-[2-(dimethylamino)ethyl]-5-nitropyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~4~-(3-chlorophenyl)-N~2~-[2-(dimethylamino)ethyl]-5-nitropyrimidine-2,4,6-triamine
N~4~-(3-chlorophenyl)-N~2~-[2-(dimethylamino)ethyl]-5-nitropyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0204 |
| Compound Name: | N~4~-(3-chlorophenyl)-N~2~-[2-(dimethylamino)ethyl]-5-nitropyrimidine-2,4,6-triamine |
| Molecular Weight: | 351.79 |
| Molecular Formula: | C14 H18 Cl N7 O2 |
| Smiles: | CN(C)CCNc1nc(c(c(Nc2cccc(c2)[Cl])n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 2.9125 |
| logD: | 1.293 |
| logSw: | -3.6654 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 97.186 |
| InChI Key: | QGLXFFXXKYQWEU-UHFFFAOYSA-N |