N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}acetamide
Chemical Structure Depiction of
N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}acetamide
N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}acetamide
Compound characteristics
| Compound ID: | 1309-1262 |
| Compound Name: | N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}acetamide |
| Molecular Weight: | 366.69 |
| Molecular Formula: | C13 H14 Cl3 N3 O S |
| Smiles: | CC(NC(C([Cl])([Cl])[Cl])Nc1c(C#N)c2CCCCc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2445 |
| logD: | 3.2189 |
| logSw: | -4.1074 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.392 |
| InChI Key: | HYHZYFKITSMITF-LBPRGKRZSA-N |