2-{[(2,3-dimethoxyphenyl)methyl]amino}-N-(2-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
2-{[(2,3-dimethoxyphenyl)methyl]amino}-N-(2-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
2-{[(2,3-dimethoxyphenyl)methyl]amino}-N-(2-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | K801-0642 |
| Compound Name: | 2-{[(2,3-dimethoxyphenyl)methyl]amino}-N-(2-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 466.6 |
| Molecular Formula: | C26 H30 N2 O4 S |
| Smiles: | COc1ccccc1NC(c1c2CCCCCc2sc1NCc1cccc(c1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8505 |
| logD: | 5.8503 |
| logSw: | -5.528 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.89 |
| InChI Key: | FEZAPMYQQDINAW-UHFFFAOYSA-N |