2-[2-(4-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-[2-(4-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-(3-methylbutyl)acetamide
2-[2-(4-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | F714-0498 |
| Compound Name: | 2-[2-(4-methylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 414.57 |
| Molecular Formula: | C23 H30 N2 O3 S |
| Smiles: | CC(C)CCNC(CC1c2ccccc2CCN1S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3487 |
| logD: | 4.3487 |
| logSw: | -4.0118 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.238 |
| InChI Key: | YUYQFQDQTTZECQ-QFIPXVFZSA-N |