2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3-chlorophenyl)-7,8-dihydroquinazolin-5(6H)-one
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3-chlorophenyl)-7,8-dihydroquinazolin-5(6H)-one
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3-chlorophenyl)-7,8-dihydroquinazolin-5(6H)-one
Compound characteristics
| Compound ID: | 8137-0160 |
| Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-7-(3-chlorophenyl)-7,8-dihydroquinazolin-5(6H)-one |
| Molecular Weight: | 476.96 |
| Molecular Formula: | C26 H25 Cl N4 O3 |
| Smiles: | C1C(Cc2c(cnc(n2)N2CCN(CC2)Cc2ccc3c(c2)OCO3)C1=O)c1cccc(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2814 |
| logD: | 3.556 |
| logSw: | -4.502 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.764 |
| InChI Key: | BUEMFYMBXSFYRU-IBGZPJMESA-N |