N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylethanesulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylethanesulfonamide
N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylethanesulfonamide
Compound characteristics
| Compound ID: | J019-0278 |
| Compound Name: | N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylethanesulfonamide |
| Molecular Weight: | 414.54 |
| Molecular Formula: | C21 H22 N2 O3 S2 |
| Smiles: | CCS(N(C)c1ccc2c(c1)cc(C(N1CCc3ccccc3C1)=O)s2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1664 |
| logD: | 4.1664 |
| logSw: | -4.1005 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.282 |
| InChI Key: | FBVPBPIYHMHVCZ-UHFFFAOYSA-N |