4-{4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl}-4-oxobutanoic acid
Chemical Structure Depiction of
4-{4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl}-4-oxobutanoic acid
4-{4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl}-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 3978-0064 |
| Compound Name: | 4-{4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl}-4-oxobutanoic acid |
| Molecular Weight: | 503.78 |
| Molecular Formula: | C22 H20 Br Cl N4 O3 |
| Smiles: | C(CC(N1CCN(CC1)c1nc(c2ccccc2[Cl])c2cc(ccc2n1)[Br])=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1772 |
| logD: | 1.2278 |
| logSw: | -4.17 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.987 |
| InChI Key: | CJWRZEGXLDKDGH-UHFFFAOYSA-N |