3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-2-(phenylimino)-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-2-(phenylimino)-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazinane-6-carboxamide
3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-2-(phenylimino)-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazinane-6-carboxamide
Compound characteristics
Compound ID: | 4514-1593 |
Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-2-(phenylimino)-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazinane-6-carboxamide |
Molecular Weight: | 543.52 |
Molecular Formula: | C26 H20 F3 N3 O5 S |
Smiles: | C1C(C(Nc2ccc(cc2)OC(F)(F)F)=O)SC(=N/c2ccccc2)\N(Cc2ccc3c(c2)OCO3)C1=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.6592 |
logD: | 5.6588 |
logSw: | -5.8139 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.191 |
InChI Key: | OKQOGZRLPBGBDN-QFIPXVFZSA-N |