1-[4-amino-6-methyl-2-(4-nitrophenyl)pyrimidin-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-amino-6-methyl-2-(4-nitrophenyl)pyrimidin-5-yl]ethan-1-one
1-[4-amino-6-methyl-2-(4-nitrophenyl)pyrimidin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 6623-1007 |
| Compound Name: | 1-[4-amino-6-methyl-2-(4-nitrophenyl)pyrimidin-5-yl]ethan-1-one |
| Molecular Weight: | 272.26 |
| Molecular Formula: | C13 H12 N4 O3 |
| Smiles: | CC(c1c(C)nc(c2ccc(cc2)[N+]([O-])=O)nc1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3044 |
| logD: | 2.3043 |
| logSw: | -2.6401 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.02 |
| InChI Key: | UGHHEUOJHKIVBN-UHFFFAOYSA-N |