N-(4-bromo-2-fluorophenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide
N-(4-bromo-2-fluorophenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F184-1251 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 546.8 |
| Molecular Formula: | C20 H18 Br Cl F N3 O5 S |
| Smiles: | C1CN(CCC1C(Nc1ccc(cc1F)[Br])=O)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0133 |
| logD: | 2.9547 |
| logSw: | -3.5137 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.613 |
| InChI Key: | YAOCRGHUNYAASC-UHFFFAOYSA-N |