N~2~-[3-(dimethylamino)propyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Chemical Structure Depiction of
N~2~-[3-(dimethylamino)propyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
N~2~-[3-(dimethylamino)propyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Compound characteristics
| Compound ID: | G786-0093 |
| Compound Name: | N~2~-[3-(dimethylamino)propyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine |
| Molecular Weight: | 338.41 |
| Molecular Formula: | C14 H26 N8 O2 |
| Smiles: | CN(C)CCCNc1nc(c(c(n1)N1CCN(C)CC1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 0.7676 |
| logD: | -1.317 |
| logSw: | -0.8944 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.495 |
| InChI Key: | MMIYBDDJMCJYAY-UHFFFAOYSA-N |