2-(4-bromophenyl)-2-oxoethyl 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylate
Chemical Structure Depiction of
2-(4-bromophenyl)-2-oxoethyl 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylate
2-(4-bromophenyl)-2-oxoethyl 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylate
Compound characteristics
| Compound ID: | 8014-3083 |
| Compound Name: | 2-(4-bromophenyl)-2-oxoethyl 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylate |
| Molecular Weight: | 390.19 |
| Molecular Formula: | C17 H12 Br N O5 |
| Smiles: | C(C(c1ccc(cc1)[Br])=O)OC(c1ccc2c(c1)NC(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.985 |
| logD: | 2.985 |
| logSw: | -3.3127 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.613 |
| InChI Key: | KXFUQSJGIFKYIV-UHFFFAOYSA-N |