2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | 7913-0058 |
| Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 502.57 |
| Molecular Formula: | C28 H30 N4 O5 |
| Smiles: | COc1ccc(cc1OC)C1CC(c2cnc(nc2C1)N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3411 |
| logD: | 2.6157 |
| logSw: | -3.313 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.025 |
| InChI Key: | LCRZFMWJJWBBKN-HXUWFJFHSA-N |