methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[(pyridine-4-carbonyl)amino]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[(pyridine-4-carbonyl)amino]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[(pyridine-4-carbonyl)amino]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-9473 |
| Compound Name: | methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[(pyridine-4-carbonyl)amino]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 485.48 |
| Molecular Formula: | C21 H22 F3 N3 O5 S |
| Smiles: | CCOC(C(C(F)(F)F)(NC(c1ccncc1)=O)Nc1c(C(=O)OC)c2CCCCc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6347 |
| logD: | 1.7452 |
| logSw: | -4.089 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.598 |
| InChI Key: | ZKGXARCLKRCXHW-HXUWFJFHSA-N |