N~4~-(3,4-dimethylphenyl)-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine
Chemical Structure Depiction of
N~4~-(3,4-dimethylphenyl)-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine
N~4~-(3,4-dimethylphenyl)-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | G786-0115 |
| Compound Name: | N~4~-(3,4-dimethylphenyl)-5-nitro-2-(pyrrolidin-1-yl)pyrimidine-4,6-diamine |
| Molecular Weight: | 328.37 |
| Molecular Formula: | C16 H20 N6 O2 |
| Smiles: | Cc1ccc(cc1C)Nc1c(c(N)nc(n1)N1CCCC1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2636 |
| logD: | 4.2635 |
| logSw: | -4.4865 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.584 |
| InChI Key: | ATWGSMPLIIMOSN-UHFFFAOYSA-N |