1,6-dimethyl-5-nitro-4-(3-nitrophenyl)-3,4-dihydropyrimidin-2(1H)-one
Chemical Structure Depiction of
1,6-dimethyl-5-nitro-4-(3-nitrophenyl)-3,4-dihydropyrimidin-2(1H)-one
1,6-dimethyl-5-nitro-4-(3-nitrophenyl)-3,4-dihydropyrimidin-2(1H)-one
Compound characteristics
| Compound ID: | 1492-0487 |
| Compound Name: | 1,6-dimethyl-5-nitro-4-(3-nitrophenyl)-3,4-dihydropyrimidin-2(1H)-one |
| Molecular Weight: | 292.25 |
| Molecular Formula: | C12 H12 N4 O5 |
| Smiles: | CC1=C(C(c2cccc(c2)[N+]([O-])=O)NC(N1C)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4647 |
| logD: | 1.3619 |
| logSw: | -2.1886 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.356 |
| InChI Key: | JJHPPFAYJBSFNS-JTQLQIEISA-N |