N~2~-(3-aminopropyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~2~-(3-aminopropyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
N~2~-(3-aminopropyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0037 |
| Compound Name: | N~2~-(3-aminopropyl)-N~4~-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine |
| Molecular Weight: | 317.35 |
| Molecular Formula: | C14 H19 N7 O2 |
| Smiles: | Cc1cccc(c1)Nc1c(c(N)nc(NCCCN)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7126 |
| logD: | -0.8687 |
| logSw: | -2.0565 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 114.475 |
| InChI Key: | HCZDSMLFXWOEFP-UHFFFAOYSA-N |