N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-3-fluorobenzamide
N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V002-9521 |
| Compound Name: | N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-3-fluorobenzamide |
| Molecular Weight: | 526.01 |
| Molecular Formula: | C31 H25 Cl F N3 O2 |
| Smiles: | Cc1c(CN(Cc2ccccc2)C(c2cccc(c2)F)=O)c(n(c2cccc(c2)[Cl])n1)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.8151 |
| logD: | 6.8151 |
| logSw: | -6.2848 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.86 |
| InChI Key: | XHERQNPTRMKFFF-UHFFFAOYSA-N |