5-(4-{[2-(4-butylphenyl)quinazolin-4-yl]amino}phenoxy)-2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(4-{[2-(4-butylphenyl)quinazolin-4-yl]amino}phenoxy)-2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
5-(4-{[2-(4-butylphenyl)quinazolin-4-yl]amino}phenoxy)-2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3764-6528 |
| Compound Name: | 5-(4-{[2-(4-butylphenyl)quinazolin-4-yl]amino}phenoxy)-2-[2-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 658.68 |
| Molecular Formula: | C39 H29 F3 N4 O3 |
| Smiles: | CCCCc1ccc(cc1)c1nc(c2ccccc2n1)Nc1ccc(cc1)Oc1ccc2C(N(C(c2c1)=O)c1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 11.2354 |
| logD: | 10.9775 |
| logSw: | -5.8986 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.893 |
| InChI Key: | JYSFASQYASSFKS-UHFFFAOYSA-N |