CID 6764310
PubChem CID
6764310
Structure
Preferred Compound
Molecular Formula
Status
Non-live
Molecular Weight
381.4 g/mol
Dates
- Create:2006-06-06
Chemical Structure Depiction
3,4-dimethoxy-N-[[1-(2-methylpropyl)-2-oxoindol-3-ylidene]amino]benzamide
InChI=1S/C21H23N3O4/c1-13(2)12-24-16-8-6-5-7-15(16)19(21(24)26)22-23-20(25)14-9-10-17(27-3)18(11-14)28-4/h5-11,13H,12H2,1-4H3,(H,23,25)
VPWWYOGHURAUOW-UHFFFAOYSA-N
CC(C)CN1C2=CC=CC=C2C(=NNC(=O)C3=CC(=C(C=C3)OC)OC)C1=O
C21H23N3O4
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
381.4 g/mol
Property Name
XLogP3-AA
Property Value
4.2
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
5
Property Name
Rotatable Bond Count
Property Value
6
Property Name
Exact Mass
Property Value
381.16885622 g/mol
Property Name
Monoisotopic Mass
Property Value
381.16885622 g/mol
Property Name
Topological Polar Surface Area
Property Value
80.2 A^2
Property Name
Heavy Atom Count
Property Value
28
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
606
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
1
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
Old substance
Old substance
Old substance
CONTENTS