4-chloro-3-(3,4-dimethylanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate
Chemical Structure Depiction of
4-chloro-3-(3,4-dimethylanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate
4-chloro-3-(3,4-dimethylanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate
Compound characteristics
| Compound ID: | 5052-0143 |
| Compound Name: | 4-chloro-3-(3,4-dimethylanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate |
| Molecular Weight: | 436.69 |
| Molecular Formula: | C19 H15 Br Cl N O4 |
| Smiles: | Cc1ccc(cc1C)NC1C(OC(C=1[Cl])=O)OC(c1ccccc1[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1691 |
| logD: | 5.1415 |
| logSw: | -5.4106 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.636 |
| InChI Key: | YIZJHCZFWNJNNB-IBGZPJMESA-N |