N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide
Chemical Structure Depiction of
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide
Compound characteristics
| Compound ID: | V020-7632 |
| Compound Name: | N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide |
| Molecular Weight: | 465.5 |
| Molecular Formula: | C24 H20 F N3 O4 S |
| Smiles: | CN(CC(N1C(CC(c2cccs2)=N1)c1ccc2c(c1)OCO2)=O)C(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9325 |
| logD: | 3.9325 |
| logSw: | -4.0294 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.143 |
| InChI Key: | QJBMPTRBDFNDBM-LJQANCHMSA-N |