N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methylcyclobutanecarboxamide
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-methylcyclobutanecarboxamide
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methylcyclobutanecarboxamide
Compound characteristics
| Compound ID: | V021-2241 |
| 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-methylcyclobutanecarboxamide |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | CN(CC(N1C(CC(c2cccs2)=N1)c1ccc2c(c1)OCO2)=O)C(C1CCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2578 |
| logD: | 3.2578 |
| logSw: | -3.2607 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.666 |
| InChI Key: | MMNGFPNONLVVJL-QGZVFWFLSA-N |