4-{[2-(4-methoxyphenyl)-6-methyl-4H-1-benzopyran-4-ylidene]amino}phenyl 4-fluorobenzoate--hydrogen tetrafluoridoborate (1/1)
Chemical Structure Depiction of
4-{[2-(4-methoxyphenyl)-6-methyl-4H-1-benzopyran-4-ylidene]amino}phenyl 4-fluorobenzoate--hydrogen tetrafluoridoborate (1/1)
4-{[2-(4-methoxyphenyl)-6-methyl-4H-1-benzopyran-4-ylidene]amino}phenyl 4-fluorobenzoate--hydrogen tetrafluoridoborate (1/1)
Compound characteristics
| Compound ID: | 6197-5210 |
| Compound Name: | 4-{[2-(4-methoxyphenyl)-6-methyl-4H-1-benzopyran-4-ylidene]amino}phenyl 4-fluorobenzoate--hydrogen tetrafluoridoborate (1/1) |
| Molecular Weight: | 567.32 |
| Molecular Formula: | C30 H22 F N O4 |
| Salt: | HBF4 |
| Smiles: | Cc1ccc2c(c1)C(/C=C(c1ccc(cc1)OC)O2)=N/c1ccc(cc1)OC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.121 |
| logD: | 5.844 |
| logSw: | -5.745 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.93 |
| InChI Key: | QITHLKYXHZLWFB-QVAGMWBUSA-N |