ethyl 6-tert-butyl-2-[(methylcarbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-tert-butyl-2-[(methylcarbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-tert-butyl-2-[(methylcarbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8008-8716 |
| Compound Name: | ethyl 6-tert-butyl-2-[(methylcarbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 354.53 |
| Molecular Formula: | C17 H26 N2 O2 S2 |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(NC)=S)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4001 |
| logD: | 3.8293 |
| logSw: | -4.2357 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.274 |
| InChI Key: | POYZURPMQXZLQK-SNVBAGLBSA-N |