929810-60-6
Product Name:
(5Z)-5-[(4-tert-butylanilino)methylidene]-1-(1,1-dioxothiolan-3-yl)-4-methyl-2,6-dioxopyridine-3-carbonitrile
Formula:
C22H25N3O4S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 427.5 g/mol |
---|---|
XLogP3 | 2.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 427.15657746 g/mol |
Monoisotopic Mass | 427.15657746 g/mol |
Topological Polar Surface Area | 119 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 962 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |