2-(4-benzylpiperidin-1-yl)-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine
Chemical Structure Depiction of
2-(4-benzylpiperidin-1-yl)-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine
2-(4-benzylpiperidin-1-yl)-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | G786-0152 |
| Compound Name: | 2-(4-benzylpiperidin-1-yl)-5-nitro-N~4~-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C21 H28 N6 O3 |
| Smiles: | C1CC(CNc2c(c(N)nc(n2)N2CCC(CC2)Cc2ccccc2)[N+]([O-])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0042 |
| logD: | 4.0042 |
| logSw: | -4.4217 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.922 |
| InChI Key: | USTZNXHZCDZFMC-QGZVFWFLSA-N |