4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoic acid--hydrogen chloride (1/1)
4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4358-1605 |
| Compound Name: | 4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 446.72 |
| Molecular Formula: | C21 H13 Cl2 N3 O2 |
| Salt: | HCl |
| Smiles: | c1ccc2c(c1)c(Nc1ccc(cc1)C(O)=O)nc(c1ccc(cc1[Cl])[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 6.1803 |
| logD: | 3.7851 |
| logSw: | -5.8922 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.213 |
| InChI Key: | BEXYKWSWJSNGQI-UHFFFAOYSA-N |