N~2~-(3,4-dimethylphenyl)-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~2~-(3,4-dimethylphenyl)-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-2,4,6-triamine
N~2~-(3,4-dimethylphenyl)-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0149 |
| Compound Name: | N~2~-(3,4-dimethylphenyl)-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(cc1C)Nc1nc(c(c(NCC2CCCO2)n1)[N+]([O-])=O)N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.461 |
| logD: | 3.4607 |
| logSw: | -3.8479 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 101.861 |
| InChI Key: | JKEWGBJXQXXVLM-CYBMUJFWSA-N |