(azepan-1-yl)[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-3-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-3-yl]methanone
(azepan-1-yl)[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-3-yl]methanone
Compound characteristics
| Compound ID: | F540-1658 |
| Compound Name: | (azepan-1-yl)[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-3-yl]methanone |
| Molecular Weight: | 404.55 |
| Molecular Formula: | C20 H24 N2 O3 S2 |
| Smiles: | C1CCCN(CC1)C(c1cc(sc1)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6774 |
| logD: | 3.6774 |
| logSw: | -3.882 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.609 |
| InChI Key: | LAZPPOLJIYHOJJ-UHFFFAOYSA-N |