N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-4-(trifluoromethyl)benzamide
N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V006-9716 |
| Compound Name: | N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 639.63 |
| Molecular Formula: | C32 H32 F3 N5 O6 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)C1CC(c2ccc(cc2)[N+]([O-])=O)=NN1C(CN(CCN1CCOCC1)C(c1ccc(cc1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5568 |
| logD: | 4.5521 |
| logSw: | -4.2687 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 95.593 |
| InChI Key: | ZHYRVFFVGTXFJX-LJAQVGFWSA-N |