N~2~-(3,4-dimethylphenyl)-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~2~-(3,4-dimethylphenyl)-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine
N~2~-(3,4-dimethylphenyl)-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0143 |
| Compound Name: | N~2~-(3,4-dimethylphenyl)-N~4~-[(furan-2-yl)methyl]-5-nitropyrimidine-2,4,6-triamine |
| Molecular Weight: | 354.37 |
| Molecular Formula: | C17 H18 N6 O3 |
| Smiles: | Cc1ccc(cc1C)Nc1nc(c(c(NCc2ccco2)n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 4.3567 |
| logD: | 4.3542 |
| logSw: | -4.572 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 100.956 |
| InChI Key: | POKICEMLTVVMKV-UHFFFAOYSA-N |