N-{3-[2-(pyridin-4-yl)ethyl]phenyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-{3-[2-(pyridin-4-yl)ethyl]phenyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-{3-[2-(pyridin-4-yl)ethyl]phenyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 8018-0100 |
| Compound Name: | N-{3-[2-(pyridin-4-yl)ethyl]phenyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 362.49 |
| Molecular Formula: | C22 H22 N2 O S |
| Smiles: | C1CCc2c(C1)c(cs2)C(Nc1cccc(CCc2ccncc2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8344 |
| logD: | 4.818 |
| logSw: | -4.7235 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.425 |
| InChI Key: | DOAMYOKQSRHGGY-UHFFFAOYSA-N |