N-tert-butyl-2-fluoro-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide
Chemical Structure Depiction of
N-tert-butyl-2-fluoro-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide
N-tert-butyl-2-fluoro-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide
Compound characteristics
Compound ID: | V021-9737 |
Compound Name: | N-tert-butyl-2-fluoro-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}benzamide |
Molecular Weight: | 522.68 |
Molecular Formula: | C30 H35 F N2 O3 S |
Smiles: | CC(C)c1ccc(cc1)OCC1c2ccsc2CCN1C(CN(C(c1ccccc1F)=O)C(C)(C)C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.5765 |
logD: | 6.5765 |
logSw: | -5.7583 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.393 |
InChI Key: | VTCSMJVMKNUWQP-SANMLTNESA-N |