N~2~-[(4-methylphenyl)methyl]-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~2~-[(4-methylphenyl)methyl]-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-2,4,6-triamine
N~2~-[(4-methylphenyl)methyl]-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0148 |
| Compound Name: | N~2~-[(4-methylphenyl)methyl]-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-2,4,6-triamine |
| Molecular Weight: | 358.4 |
| Molecular Formula: | C17 H22 N6 O3 |
| Smiles: | Cc1ccc(CNc2nc(c(c(NCC3CCCO3)n2)[N+]([O-])=O)N)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4341 |
| logD: | 2.4341 |
| logSw: | -2.7467 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 103.183 |
| InChI Key: | WCTYWDMAAFIPFF-CYBMUJFWSA-N |