methyl 2-{[7-(4-fluorophenyl)-1,7-dimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[7-(4-fluorophenyl)-1,7-dimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carbonyl]amino}benzoate
methyl 2-{[7-(4-fluorophenyl)-1,7-dimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C893-0641 |
| Compound Name: | methyl 2-{[7-(4-fluorophenyl)-1,7-dimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carbonyl]amino}benzoate |
| Molecular Weight: | 487.48 |
| Molecular Formula: | C28 H22 F N O6 |
| Smiles: | Cc1c2c3C(CC(C)(c4ccc(cc4)F)Oc3ccc2oc1C(Nc1ccccc1C(=O)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4461 |
| logD: | 4.8167 |
| logSw: | -5.6533 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.593 |
| InChI Key: | VVBUNPJVBKRTFZ-NDEPHWFRSA-N |