6-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methoxy-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
6-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methoxy-1-benzothiophene-2-carboxamide
6-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methoxy-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | M648-1563 |
| Compound Name: | 6-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methoxy-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 400.93 |
| Molecular Formula: | C21 H21 Cl N2 O2 S |
| Smiles: | COc1c2ccc(cc2sc1C(NCCN1CCc2ccccc2C1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6225 |
| logD: | 4.4139 |
| logSw: | -4.6351 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.602 |
| InChI Key: | RJVKKGYGRFFSLV-UHFFFAOYSA-N |