ethyl 4-{[3-(1H-benzimidazol-2-yl)-2H-1-benzopyran-2-ylidene]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[3-(1H-benzimidazol-2-yl)-2H-1-benzopyran-2-ylidene]amino}benzoate
ethyl 4-{[3-(1H-benzimidazol-2-yl)-2H-1-benzopyran-2-ylidene]amino}benzoate
Compound characteristics
| Compound ID: | 2103-2550 |
| Compound Name: | ethyl 4-{[3-(1H-benzimidazol-2-yl)-2H-1-benzopyran-2-ylidene]amino}benzoate |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C25 H19 N3 O3 |
| Smiles: | CCOC(c1ccc(cc1)/N=C1/C(=Cc2ccccc2O1)c1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1514 |
| logD: | 4.9993 |
| logSw: | -5.1625 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.718 |
| InChI Key: | AQSVTVPVCDQYII-UHFFFAOYSA-N |