3-{[(5-bromo-2-fluorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-{[(5-bromo-2-fluorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one
3-{[(5-bromo-2-fluorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 3651-6139 |
| Compound Name: | 3-{[(5-bromo-2-fluorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 484.32 |
| Molecular Formula: | C23 H19 Br F N3 O3 |
| Smiles: | COc1ccc(cc1OC)C1=Nc2ccccc2C(N1NCc1cc(ccc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7971 |
| logD: | 3.797 |
| logSw: | -4.024 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.137 |
| InChI Key: | HCKICHBFRKDCMJ-UHFFFAOYSA-N |