N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide
Chemical Structure Depiction of
N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide
N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide
Compound characteristics
| Compound ID: | V002-6193 |
| Compound Name: | N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide |
| Molecular Weight: | 452.91 |
| Molecular Formula: | C24 H22 Cl F N4 O2 |
| Smiles: | CN(CC(N1C(CC(c2cccn2C)=N1)c1ccc(cc1)[Cl])=O)C(c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5674 |
| logD: | 4.5674 |
| logSw: | -5.0536 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.426 |
| InChI Key: | XUPHPTLJKPCSKV-QFIPXVFZSA-N |