2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(1S)-3-methyl-1-(1-methyl-1H-benzimidazol-2-yl)butyl]acetamide
Chemical Structure Depiction of
2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(1S)-3-methyl-1-(1-methyl-1H-benzimidazol-2-yl)butyl]acetamide
2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(1S)-3-methyl-1-(1-methyl-1H-benzimidazol-2-yl)butyl]acetamide
Compound characteristics
| Compound ID: | Y042-7299 |
| Compound Name: | 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(1S)-3-methyl-1-(1-methyl-1H-benzimidazol-2-yl)butyl]acetamide |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C24 H29 N3 O3 |
| Smiles: | CC(C)C[C@@H](c1nc2ccccc2n1C)NC(Cc1ccc2c(c1)OCCCO2)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.5156 |
| logD: | 3.4989 |
| logSw: | -3.7314 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.233 |
| InChI Key: | MGXOAOGOLMGQNV-IBGZPJMESA-N |