N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-{3-[(morpholin-4-yl)(oxo)acetyl]-1H-indol-1-yl}acetamide
Chemical Structure Depiction of
N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-{3-[(morpholin-4-yl)(oxo)acetyl]-1H-indol-1-yl}acetamide
N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-{3-[(morpholin-4-yl)(oxo)acetyl]-1H-indol-1-yl}acetamide
Compound characteristics
| Compound ID: | J031-1527 |
| Compound Name: | N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-{3-[(morpholin-4-yl)(oxo)acetyl]-1H-indol-1-yl}acetamide |
| Molecular Weight: | 477.52 |
| Molecular Formula: | C26 H27 N3 O6 |
| Smiles: | C1COc2ccc(CNC(Cn3cc(C(C(N4CCOCC4)=O)=O)c4ccccc34)=O)cc2OC1 |
| Stereo: | ACHIRAL |
| logP: | 1.4365 |
| logD: | 1.4365 |
| logSw: | -2.5207 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.892 |
| InChI Key: | NEQAVGGVFQXHTR-UHFFFAOYSA-N |