2-({[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-4-chlorobenzoic acid
Chemical Structure Depiction of
2-({[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-4-chlorobenzoic acid
2-({[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-4-chlorobenzoic acid
Compound characteristics
| Compound ID: | 2084-9964 |
| Compound Name: | 2-({[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-4-chlorobenzoic acid |
| Molecular Weight: | 421.63 |
| Molecular Formula: | C17 H10 Br Cl N2 O4 |
| Smiles: | C(=C1/C(=O)OC(c2ccc(cc2)[Br])=N1)\Nc1cc(ccc1C(O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7769 |
| logD: | 1.3915 |
| logSw: | -4.5861 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.687 |
| InChI Key: | VSMWRNBKGNXXJB-UHFFFAOYSA-N |