methyl 4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
methyl 4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoate--hydrogen chloride (1/1)
methyl 4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4358-1601 |
| Compound Name: | methyl 4-{[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino}benzoate--hydrogen chloride (1/1) |
| Molecular Weight: | 460.75 |
| Molecular Formula: | C22 H15 Cl2 N3 O2 |
| Salt: | HCl |
| Smiles: | COC(c1ccc(cc1)Nc1c2ccccc2nc(c2ccc(cc2[Cl])[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4228 |
| logD: | 6.3642 |
| logSw: | -6.3132 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.979 |
| InChI Key: | GNZNJIBEGNQSAU-UHFFFAOYSA-N |