(azepan-1-yl)[2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone
(azepan-1-yl)[2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone
Compound characteristics
| Compound ID: | 3347-0009 |
| Compound Name: | (azepan-1-yl)[2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone |
| Molecular Weight: | 428.55 |
| Molecular Formula: | C23 H28 N2 O4 S |
| Smiles: | COc1ccc(cc1)S(N1Cc2ccccc2CC1C(N1CCCCCC1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1457 |
| logD: | 4.1457 |
| logSw: | -4.1024 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.605 |
| InChI Key: | TWXBSGCKPOVUFL-QFIPXVFZSA-N |