{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | G365-0460 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)methanone |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C23 H22 N4 O4 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1c2COc3ccccc3c2[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4678 |
| logD: | 2.2745 |
| logSw: | -3.0764 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.034 |
| InChI Key: | TUYRRJSFMPMFNX-UHFFFAOYSA-N |