N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-4-(trifluoromethyl)benzamide
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}-N-(2-methoxyethyl)-4-(trifluoromethyl)benzamide
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V031-1898 |
| Compound Name: | N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 559.56 |
| Molecular Formula: | C27 H24 F3 N3 O5 S |
| Salt: | not_available |
| Smiles: | COCCN(CC(N1C(CC(c2cccs2)=N1)c1ccc2c(c1)OCO2)=O)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7968 |
| logD: | 4.7968 |
| logSw: | -4.6914 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.524 |
| InChI Key: | YDDGGRCXYDFYCY-OAQYLSRUSA-N |