2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(2,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(2,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(2,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | 7752-0608 |
| Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(2,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 502.57 |
| Molecular Formula: | C28 H30 N4 O5 |
| Smiles: | COc1ccc(C2CC(c3cnc(nc3C2)N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9526 |
| logD: | 3.2273 |
| logSw: | -3.9975 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.939 |
| InChI Key: | HPFOHVNBVRTRFC-LJQANCHMSA-N |