N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dimethoxy-N-pentylbenzamide
Chemical Structure Depiction of
N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dimethoxy-N-pentylbenzamide
N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dimethoxy-N-pentylbenzamide
Compound characteristics
| Compound ID: | V027-0965 |
| Compound Name: | N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dimethoxy-N-pentylbenzamide |
| Molecular Weight: | 544.63 |
| Molecular Formula: | C31 H33 F N4 O4 |
| Salt: | not_available |
| Smiles: | CCCCCN(CC(Nc1cc(c2ccccc2)nn1c1ccc(cc1)F)=O)C(c1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.562 |
| logD: | 6.562 |
| logSw: | -5.6279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.915 |
| InChI Key: | CLOJVPMCDYHHKN-UHFFFAOYSA-N |