ethyl 6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]thiophen-2-yl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]thiophen-2-yl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
ethyl 6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]thiophen-2-yl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8017-1892 |
| Compound Name: | ethyl 6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]thiophen-2-yl}-5-cyano-2-methyl-4H-pyran-3-carboxylate |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C22 H20 N4 O3 S |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1C)c1cc(Cn2cnc3ccccc23)cs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7085 |
| logD: | 2.7054 |
| logSw: | -3.0041 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.649 |
| InChI Key: | MEWZEUVUVJGWRB-FQEVSTJZSA-N |