N-[(3,4-dimethoxyphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
N-[(3,4-dimethoxyphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y205-4029 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 331.43 |
| Molecular Formula: | C18 H21 N O3 S |
| Smiles: | COc1ccc(CNC(c2cc3CCCCc3s2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.3963 |
| logD: | 3.3963 |
| logSw: | -3.6304 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.852 |
| InChI Key: | KVIBFUYWCFYWKS-UHFFFAOYSA-N |