N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y207-0909 |
| Compound Name: | N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide |
| Molecular Weight: | 347.38 |
| Molecular Formula: | C13 H12 F3 N3 O S2 |
| Smiles: | C1CCc2cc(C(Nc3nnc(C(F)(F)F)s3)=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7044 |
| logD: | 2.702 |
| logSw: | -4.5287 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.145 |
| InChI Key: | CTJXYALOVPYTFX-UHFFFAOYSA-N |