ethyl 4-{[3-(1H-benzimidazol-2-yl)-8-methoxy-2H-1-benzopyran-2-ylidene]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[3-(1H-benzimidazol-2-yl)-8-methoxy-2H-1-benzopyran-2-ylidene]amino}benzoate
ethyl 4-{[3-(1H-benzimidazol-2-yl)-8-methoxy-2H-1-benzopyran-2-ylidene]amino}benzoate
Compound characteristics
| Compound ID: | 2103-2553 |
| Compound Name: | ethyl 4-{[3-(1H-benzimidazol-2-yl)-8-methoxy-2H-1-benzopyran-2-ylidene]amino}benzoate |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C26 H21 N3 O4 |
| Smiles: | CCOC(c1ccc(cc1)/N=C1/C(=Cc2cccc(c2O1)OC)c1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0434 |
| logD: | 4.5993 |
| logSw: | -4.7074 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.033 |
| InChI Key: | ROHVQLRGFZAKDV-UHFFFAOYSA-N |