methyl 4-{[2-(3-nitrophenyl)quinazolin-4-yl]oxy}benzoate
Chemical Structure Depiction of
methyl 4-{[2-(3-nitrophenyl)quinazolin-4-yl]oxy}benzoate
methyl 4-{[2-(3-nitrophenyl)quinazolin-4-yl]oxy}benzoate
Compound characteristics
| Compound ID: | 5001-0311 |
| Compound Name: | methyl 4-{[2-(3-nitrophenyl)quinazolin-4-yl]oxy}benzoate |
| Molecular Weight: | 401.38 |
| Molecular Formula: | C22 H15 N3 O5 |
| Smiles: | COC(c1ccc(cc1)Oc1c2ccccc2nc(c2cccc(c2)[N+]([O-])=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0659 |
| logD: | 6.0659 |
| logSw: | -5.9483 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.314 |
| InChI Key: | GPNMDRYPGCCTSE-UHFFFAOYSA-N |