N~2~-[(4-chlorophenyl)methyl]-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~2~-[(4-chlorophenyl)methyl]-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine
N~2~-[(4-chlorophenyl)methyl]-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0142 |
| Compound Name: | N~2~-[(4-chlorophenyl)methyl]-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine |
| Molecular Weight: | 374.78 |
| Molecular Formula: | C16 H15 Cl N6 O3 |
| Smiles: | C(c1ccc(cc1)[Cl])Nc1nc(c(c(NCc2ccco2)n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 3.5012 |
| logD: | 3.5008 |
| logSw: | -3.8773 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 102.278 |
| InChI Key: | DFSRPCKFIRAXGH-UHFFFAOYSA-N |