ethyl 2-[({2,2,2-trichloro-1-[(furan-2-carbonyl)amino]ethyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[({2,2,2-trichloro-1-[(furan-2-carbonyl)amino]ethyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[({2,2,2-trichloro-1-[(furan-2-carbonyl)amino]ethyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 0896-8958 |
| Compound Name: | ethyl 2-[({2,2,2-trichloro-1-[(furan-2-carbonyl)amino]ethyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 524.87 |
| Molecular Formula: | C19 H20 Cl3 N3 O4 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(NC(C([Cl])([Cl])[Cl])NC(c1ccco1)=O)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6044 |
| logD: | 4.3252 |
| logSw: | -4.8298 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.407 |
| InChI Key: | YVEHDNADUDYTKZ-KRWDZBQOSA-N |