2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[(1S)-2-methyl-1-(1-methyl-1H-benzimidazol-2-yl)propyl]acetamide
Chemical Structure Depiction of
2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[(1S)-2-methyl-1-(1-methyl-1H-benzimidazol-2-yl)propyl]acetamide
2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[(1S)-2-methyl-1-(1-methyl-1H-benzimidazol-2-yl)propyl]acetamide
Compound characteristics
| Compound ID: | Y042-7135 |
| Compound Name: | 2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[(1S)-2-methyl-1-(1-methyl-1H-benzimidazol-2-yl)propyl]acetamide |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C26 H29 N3 O5 |
| Smiles: | CC(C)[C@@H](c1nc2ccccc2n1C)NC(CC1=C(C)c2ccc(c(c2OC1=O)OC)OC)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.8063 |
| logD: | 3.8019 |
| logSw: | -4.1299 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.754 |
| InChI Key: | MLAUKTFSAPWHEK-QFIPXVFZSA-N |