N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-fluorobenzamide
Chemical Structure Depiction of
N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-fluorobenzamide
N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | V022-9612 |
| Compound Name: | N-tert-butyl-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-fluorobenzamide |
| Molecular Weight: | 508.66 |
| Molecular Formula: | C29 H33 F N2 O3 S |
| Smiles: | Cc1ccc(c(C)c1)OCC1c2ccsc2CCN1C(CN(C(c1ccc(cc1)F)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3347 |
| logD: | 6.3347 |
| logSw: | -5.5117 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.48 |
| InChI Key: | UXBGPFIKRBPHKJ-DEOSSOPVSA-N |