4-chloro-3-(3-methoxyanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate
Chemical Structure Depiction of
4-chloro-3-(3-methoxyanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate
4-chloro-3-(3-methoxyanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate
Compound characteristics
| Compound ID: | 5052-0135 |
| Compound Name: | 4-chloro-3-(3-methoxyanilino)-5-oxo-2,5-dihydrofuran-2-yl 2-bromobenzoate |
| Molecular Weight: | 438.66 |
| Molecular Formula: | C18 H13 Br Cl N O5 |
| Smiles: | COc1cccc(c1)NC1C(OC(C=1[Cl])=O)OC(c1ccccc1[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2481 |
| logD: | 4.014 |
| logSw: | -4.5383 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.18 |
| InChI Key: | CTNFXVYHVMQZOW-SFHVURJKSA-N |