3-[(6-chloro-2-phenyl-4H-1-benzopyran-4-ylidene)amino]benzoic acid--hydrogen tetrafluoridoborate (1/1)
Chemical Structure Depiction of
3-[(6-chloro-2-phenyl-4H-1-benzopyran-4-ylidene)amino]benzoic acid--hydrogen tetrafluoridoborate (1/1)
3-[(6-chloro-2-phenyl-4H-1-benzopyran-4-ylidene)amino]benzoic acid--hydrogen tetrafluoridoborate (1/1)
Compound characteristics
| Compound ID: | 6197-5108 |
| Compound Name: | 3-[(6-chloro-2-phenyl-4H-1-benzopyran-4-ylidene)amino]benzoic acid--hydrogen tetrafluoridoborate (1/1) |
| Molecular Weight: | 463.62 |
| Molecular Formula: | C22 H14 Cl N O3 |
| Salt: | HBF4 |
| Smiles: | C1=C(c2ccccc2)Oc2ccc(cc2C\1=N/c1cccc(c1)C(O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.296 |
| logD: | 6.296 |
| logSw: | -5.981 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.42 |
| InChI Key: | IVYCIWCNACOSHZ-LYBHJNIJSA-N |