3-({[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoic acid
Chemical Structure Depiction of
3-({[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoic acid
3-({[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoic acid
Compound characteristics
| Compound ID: | 2113-0090 |
| Compound Name: | 3-({[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoic acid |
| Molecular Weight: | 342.74 |
| Molecular Formula: | C17 H11 Cl N2 O4 |
| Smiles: | C(=C1/C(=O)OC(c2ccc(cc2)[Cl])=N1)\Nc1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.64 |
| logD: | 0.7542 |
| logSw: | -4.1868 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.385 |
| InChI Key: | BOBNXEOETNRFBJ-UHFFFAOYSA-N |