1-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one
1-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V017-8895 |
| Compound Name: | 1-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-methylpiperidin-1-yl)ethan-1-one |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C25 H29 N3 O4 |
| Salt: | not_available |
| Smiles: | CC1CCN(CC1)CC(N1C(CC(c2ccc(cc2)OC)=N1)c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3591 |
| logD: | 4.1786 |
| logSw: | -4.2829 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.251 |
| InChI Key: | YMDVFLFKHKUDBH-QFIPXVFZSA-N |