N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}thiophene-2-carboxamide
N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 1611-4320 |
| Compound Name: | N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}thiophene-2-carboxamide |
| Molecular Weight: | 434.79 |
| Molecular Formula: | C16 H14 Cl3 N3 O S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(C([Cl])([Cl])[Cl])NC(c1cccs1)=O)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.767 |
| logD: | 4.7128 |
| logSw: | -5.131 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.239 |
| InChI Key: | URUMDWQFFQDLQU-HNNXBMFYSA-N |