2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-methyl-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-methyl-7,8-dihydroquinazolin-5(6H)-one
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-methyl-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | Y020-1403 |
| Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-methyl-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 380.45 |
| Molecular Formula: | C21 H24 N4 O3 |
| Smiles: | CC1CC(c2cnc(nc2C1)N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7396 |
| logD: | 2.0142 |
| logSw: | -3.0628 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.036 |
| InChI Key: | FWRRIXPJVYDZPU-CQSZACIVSA-N |