{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-phenylcinnolin-4-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-phenylcinnolin-4-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-phenylcinnolin-4-yl)methanone
Compound characteristics
| Compound ID: | F146-1710 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-phenylcinnolin-4-yl)methanone |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C27 H24 N4 O3 |
| Smiles: | [H]c1ccc2c(c1)c(C(N1CCN(CC1)Cc1ccc3c(c1)OCO3)=O)c(c1ccccc1)nn2 |
| Stereo: | ACHIRAL |
| logP: | 3.3407 |
| logD: | 3.1491 |
| logSw: | -3.5723 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.5 |
| InChI Key: | NPKYCODKZMODRG-UHFFFAOYSA-N |