N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamide
Compound characteristics
| Compound ID: | Y042-7398 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamide |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C26 H29 N3 O5 |
| Smiles: | CC(C)C[C@@H](c1nc2ccccc2[nH]1)NC(CC1=C(C)c2ccc(c(c2OC1=O)OC)OC)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.0876 |
| logD: | 4.0863 |
| logSw: | -4.4547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.313 |
| InChI Key: | PISIBHOIDFTAOZ-FQEVSTJZSA-N |