3-(3-nitrophenyl)-4-[2-(trifluoromethyl)phenyl]-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
3-(3-nitrophenyl)-4-[2-(trifluoromethyl)phenyl]-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
3-(3-nitrophenyl)-4-[2-(trifluoromethyl)phenyl]-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | 8018-0070 |
| Compound Name: | 3-(3-nitrophenyl)-4-[2-(trifluoromethyl)phenyl]-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one |
| Molecular Weight: | 403.32 |
| Molecular Formula: | C19 H12 F3 N3 O4 |
| Smiles: | C1C(c2ccccc2C(F)(F)F)c2c(c3cccc(c3)[N+]([O-])=O)n[nH]c2OC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2205 |
| logD: | 4.2205 |
| logSw: | -4.5597 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.935 |
| InChI Key: | ZGGQKNAEIGWHBS-CYBMUJFWSA-N |