3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide
Chemical Structure Depiction of
3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide
3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | 4085-0070 |
| Compound Name: | 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide |
| Molecular Weight: | 439.89 |
| Molecular Formula: | C20 H17 Cl F3 N3 O S |
| Smiles: | C1CCc2cc3c(c(C(Nc4cc(ccc4[Cl])C(F)(F)F)=O)sc3nc2CC1)N |
| Stereo: | ACHIRAL |
| logP: | 5.9792 |
| logD: | 5.8884 |
| logSw: | -6.2961 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 53.491 |
| InChI Key: | IMUMOSZQRGHLJR-UHFFFAOYSA-N |