N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide
N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V003-1160 |
| Compound Name: | N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 532.04 |
| Molecular Formula: | C29 H23 Cl F N3 O2 S |
| Smiles: | Cc1c(CN(Cc2ccc(cc2)F)C(c2cccs2)=O)c(n(c2cccc(c2)[Cl])n1)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.9419 |
| logD: | 6.9419 |
| logSw: | -6.2369 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.878 |
| InChI Key: | MPKVLNJBXBCTIG-UHFFFAOYSA-N |