2-[(isoquinolin-1-yl)sulfanyl]-N,N-dimethylacetamide
Chemical Structure Depiction of
2-[(isoquinolin-1-yl)sulfanyl]-N,N-dimethylacetamide
2-[(isoquinolin-1-yl)sulfanyl]-N,N-dimethylacetamide
Compound characteristics
| Compound ID: | 8019-8898 |
| Compound Name: | 2-[(isoquinolin-1-yl)sulfanyl]-N,N-dimethylacetamide |
| Molecular Weight: | 246.33 |
| Molecular Formula: | C13 H14 N2 O S |
| Smiles: | CN(C)C(CSc1c2ccccc2ccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7471 |
| logD: | 1.7463 |
| logSw: | -2.3993 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.6193 |
| InChI Key: | LXJBVIUHUYXENJ-UHFFFAOYSA-N |