N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-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-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide
Compound characteristics
| Compound ID: | V027-7337 |
| Compound Name: | N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide |
| Molecular Weight: | 519.53 |
| Molecular Formula: | C28 H26 F N3 O6 |
| Salt: | not_available |
| Smiles: | CN(CC(N1C(CC(c2ccc(cc2OC)OC)=N1)c1ccc2c(c1)OCO2)=O)C(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0387 |
| logD: | 4.0387 |
| logSw: | -4.3575 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.299 |
| InChI Key: | JVBDCBWYZNCFOS-QHCPKHFHSA-N |