4-tert-butyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-tert-butyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)cyclohexane-1-carboxamide
4-tert-butyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | Y205-0588 |
| Compound Name: | 4-tert-butyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)cyclohexane-1-carboxamide |
| Molecular Weight: | 358.55 |
| Molecular Formula: | C21 H30 N2 O S |
| Smiles: | CC(C)(C)C1CCC(CC1)C(Nc1c(C#N)c2CCCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5572 |
| logD: | 4.8099 |
| logSw: | -5.4768 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.624 |
| InChI Key: | YQCLOAOYNDWGSG-UHFFFAOYSA-N |