3-(6-bromo-1H-indol-1-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide
Chemical Structure Depiction of
3-(6-bromo-1H-indol-1-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide
3-(6-bromo-1H-indol-1-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide
Compound characteristics
| Compound ID: | Y044-2354 |
| Compound Name: | 3-(6-bromo-1H-indol-1-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide |
| Molecular Weight: | 415.29 |
| Molecular Formula: | C20 H19 Br N2 O3 |
| Smiles: | C1COc2ccc(cc2OC1)NC(CCn1ccc2ccc(cc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9529 |
| logD: | 3.9527 |
| logSw: | -3.9634 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.359 |
| InChI Key: | CRQQBMLSAYKODV-UHFFFAOYSA-N |