N-tert-butyl-N-(2-{4-[(4-chlorophenoxy)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-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-fluorobenzamide
N-tert-butyl-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | V023-0229 |
| Compound Name: | N-tert-butyl-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-fluorobenzamide |
| Molecular Weight: | 515.05 |
| Molecular Formula: | C27 H28 Cl F N2 O3 S |
| Smiles: | CC(C)(C)N(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)[Cl])=O)C(c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6804 |
| logD: | 5.6804 |
| logSw: | -5.9419 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.393 |
| InChI Key: | UHFGAORFALKXLE-QHCPKHFHSA-N |