CID 44870629
PubChem CID
44870629
Structure
Molecular Formula
Status
Non-live
Molecular Weight
343.4 g/mol
Dates
- Create:2010-03-23
Chemical Structure Depiction
(E)-N-benzyl-N-(4-methoxyphenyl)-3-phenylprop-2-enamide
InChI=1S/C23H21NO2/c1-26-22-15-13-21(14-16-22)24(18-20-10-6-3-7-11-20)23(25)17-12-19-8-4-2-5-9-19/h2-17H,18H2,1H3/b17-12+
HAXYWLGOMAKEAP-SFQUDFHCSA-N
COC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)/C=C/C3=CC=CC=C3
C23H21NO2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
343.4 g/mol
Property Name
XLogP3-AA
Property Value
4.8
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
6
Property Name
Exact Mass
Property Value
343.157228913 g/mol
Property Name
Monoisotopic Mass
Property Value
343.157228913 g/mol
Property Name
Topological Polar Surface Area
Property Value
29.5 A^2
Property Name
Heavy Atom Count
Property Value
26
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
441
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
1
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
CONTENTS