N-(2,5-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-(2,5-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | K801-0264 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C24 H25 F N2 O3 S |
| Smiles: | COc1ccc(c(c1)NC(c1c2CCCCc2sc1NCc1cccc(c1)F)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.308 |
| logD: | 5.3068 |
| logSw: | -5.3495 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.756 |
| InChI Key: | VHNRACIDBDJLPL-UHFFFAOYSA-N |