5-methyl-7-(3-nitrophenyl)-N~3~,N~6~-diphenyl-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
Chemical Structure Depiction of
5-methyl-7-(3-nitrophenyl)-N~3~,N~6~-diphenyl-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
5-methyl-7-(3-nitrophenyl)-N~3~,N~6~-diphenyl-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
Compound characteristics
| Compound ID: | E918-0015 |
| Compound Name: | 5-methyl-7-(3-nitrophenyl)-N~3~,N~6~-diphenyl-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide |
| Molecular Weight: | 494.51 |
| Molecular Formula: | C27 H22 N6 O4 |
| Smiles: | CC1=C(C(c2cccc(c2)[N+]([O-])=O)n2c(c(cn2)C(Nc2ccccc2)=O)N1)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2037 |
| logD: | 4.2026 |
| logSw: | -4.3081 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 103.728 |
| InChI Key: | WCVGTEHEQLVKPI-DEOSSOPVSA-N |