CID 341354
PubChem CID
341354
Structure
Preferred Compound
Molecular Formula
Status
Non-live
Molecular Weight
322.28 g/mol
Dates
- Create:2005-03-26
Chemical Structure Depiction
3-cyano-2,8-dioxo-5-phenyl-6,7-dihydropyrido[2,3-d]pyridazine-4-carbohydrazide
InChI=1S/C15H10N6O3/c16-6-8-9(14(23)19-17)10-11(7-4-2-1-3-5-7)20-21-15(24)12(10)18-13(8)22/h1-5,20H,17H2,(H,19,23)(H,21,24)
WWHMVAKTHLTTAQ-UHFFFAOYSA-N
C1=CC=C(C=C1)C2=C3C(=C(C(=O)N=C3C(=O)NN2)C#N)C(=O)NN
C15H10N6O3
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
322.28 g/mol
Property Name
XLogP3-AA
Property Value
-0.5
Property Name
Hydrogen Bond Donor Count
Property Value
4
Property Name
Hydrogen Bond Acceptor Count
Property Value
6
Property Name
Rotatable Bond Count
Property Value
2
Property Name
Exact Mass
Property Value
322.08143820 g/mol
Property Name
Monoisotopic Mass
Property Value
322.08143820 g/mol
Property Name
Topological Polar Surface Area
Property Value
149 A^2
Property Name
Heavy Atom Count
Property Value
24
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
776
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
Old substance
CONTENTS