6-ethyl-3-(1-methyl-1H-benzimidazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
6-ethyl-3-(1-methyl-1H-benzimidazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl acetate
6-ethyl-3-(1-methyl-1H-benzimidazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | 4356-0181 |
| Compound Name: | 6-ethyl-3-(1-methyl-1H-benzimidazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 362.38 |
| Molecular Formula: | C21 H18 N2 O4 |
| Smiles: | CCc1cc2C(C(=COc2cc1OC(C)=O)c1nc2ccccc2n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5588 |
| logD: | 3.5588 |
| logSw: | -3.832 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.708 |
| InChI Key: | IGAKPJCNFJGPLN-UHFFFAOYSA-N |