N-[1-(2-methoxyethyl)-2-methyl-1H-indol-5-yl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-[1-(2-methoxyethyl)-2-methyl-1H-indol-5-yl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-[1-(2-methoxyethyl)-2-methyl-1H-indol-5-yl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
Compound ID: | J031-0490 |
Compound Name: | N-[1-(2-methoxyethyl)-2-methyl-1H-indol-5-yl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
Molecular Weight: | 394.47 |
Molecular Formula: | C23 H26 N2 O4 |
Smiles: | Cc1cc2c(cc1C(Nc1ccc3c(c1)cc(C)n3CCOC)=O)OCCCO2 |
Stereo: | ACHIRAL |
logP: | 3.3721 |
logD: | 3.3721 |
logSw: | -3.4464 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.501 |
InChI Key: | DOOIJRUMXWUXPG-UHFFFAOYSA-N |