N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-(3-propanoyl-1H-indol-1-yl)acetamide
Chemical Structure Depiction of
N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-(3-propanoyl-1H-indol-1-yl)acetamide
N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-(3-propanoyl-1H-indol-1-yl)acetamide
Compound characteristics
| Compound ID: | J031-1997 |
| Compound Name: | N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-(3-propanoyl-1H-indol-1-yl)acetamide |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C24 H26 N2 O4 |
| Smiles: | CCC(c1cn(CC(NCc2cc3c(cc2C)OCCCO3)=O)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9587 |
| logD: | 2.9587 |
| logSw: | -3.1056 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.843 |
| InChI Key: | ORNAWLBLXQWXOJ-UHFFFAOYSA-N |