3-({4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-({4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
3-({4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C191-0255 |
| Compound Name: | 3-({4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 549.03 |
| Molecular Formula: | C29 H29 Cl N4 O5 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(c1ccc(CN2C(c3cc(c(cc3NC2=O)OC)OC)=O)cc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4546 |
| logD: | 4.4494 |
| logSw: | -4.5763 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.349 |
| InChI Key: | IRRMEODQCJZATP-UHFFFAOYSA-N |