(azepan-1-yl)[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indol-5-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indol-5-yl]methanone
(azepan-1-yl)[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indol-5-yl]methanone
Compound characteristics
Compound ID: | D256-0394 |
Compound Name: | (azepan-1-yl)[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indol-5-yl]methanone |
Molecular Weight: | 398.52 |
Molecular Formula: | C22 H26 N2 O3 S |
Smiles: | Cc1ccc(cc1)S(N1CCc2cc(ccc12)C(N1CCCCCC1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8778 |
logD: | 3.8778 |
logSw: | -3.9218 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.736 |
InChI Key: | IODDJJVQCAHWKX-UHFFFAOYSA-N |