5-benzoyl-N-[(3-chloro-4-fluorophenyl)methyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
Chemical Structure Depiction of
5-benzoyl-N-[(3-chloro-4-fluorophenyl)methyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
5-benzoyl-N-[(3-chloro-4-fluorophenyl)methyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | P056-0553 |
| Compound Name: | 5-benzoyl-N-[(3-chloro-4-fluorophenyl)methyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide |
| Molecular Weight: | 428.91 |
| Molecular Formula: | C22 H18 Cl F N2 O2 S |
| Smiles: | C1CN(Cc2cc(C(NCc3ccc(c(c3)[Cl])F)=O)sc12)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1149 |
| logD: | 4.1149 |
| logSw: | -4.5391 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.98 |
| InChI Key: | LLJXJOOUQSHLAH-UHFFFAOYSA-N |