[5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](2-nitrophenyl)methanone
Chemical Structure Depiction of
[5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](2-nitrophenyl)methanone
[5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](2-nitrophenyl)methanone
Compound characteristics
Compound ID: | 8007-5015 |
Compound Name: | [5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](2-nitrophenyl)methanone |
Molecular Weight: | 409.32 |
Molecular Formula: | C18 H14 F3 N3 O5 |
Smiles: | COc1cccc(c1)C1(CC(C(F)(F)F)=NN1C(c1ccccc1[N+]([O-])=O)=O)O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.905 |
logD: | 2.905 |
logSw: | -3.6787 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.142 |
InChI Key: | CBDHOIWGZIXMTP-KRWDZBQOSA-N |