2-(2,2-dimethylpropanamido)-N-(4-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
2-(2,2-dimethylpropanamido)-N-(4-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
2-(2,2-dimethylpropanamido)-N-(4-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-0812 |
| Compound Name: | 2-(2,2-dimethylpropanamido)-N-(4-methoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C22 H28 N2 O3 S |
| Smiles: | CC(C)(C)C(Nc1c(C(Nc2ccc(cc2)OC)=O)c2CCCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1112 |
| logD: | 4.7759 |
| logSw: | -4.9967 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.282 |
| InChI Key: | SUPNRFZTNUEGKG-UHFFFAOYSA-N |