3-{4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-oxobutyl}-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-{4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-oxobutyl}-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
3-{4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-oxobutyl}-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C191-0164 |
| Compound Name: | 3-{4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-oxobutyl}-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 500.98 |
| Molecular Formula: | C25 H29 Cl N4 O5 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(CCCN1C(c2cc(c(cc2NC1=O)OC)OC)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1861 |
| logD: | 3.1699 |
| logSw: | -3.5977 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.071 |
| InChI Key: | YBAJTMFUWHDCDN-UHFFFAOYSA-N |