2-(3-chlorophenyl)-4-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-4-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
2-(3-chlorophenyl)-4-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8011-8703 |
| Compound Name: | 2-(3-chlorophenyl)-4-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 531.87 |
| Molecular Formula: | C25 H17 Cl F3 N3 O5 |
| Smiles: | CC1/C(=C\c2ccc(c(c2)OC)Oc2ccc(cc2C(F)(F)F)[N+]([O-])=O)C(N(c2cccc(c2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3752 |
| logD: | 6.3752 |
| logSw: | -6.3643 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.52 |
| InChI Key: | MQQMOPYGMIGFPL-UHFFFAOYSA-N |