CID 46121721
PubChem CID
46121721
Structure
Molecular Formula
Status
Non-live
Molecular Weight
409.5 g/mol
Dates
- Create:2010-06-22
Chemical Structure Depiction
N-[2-(1H-indol-3-yl)ethyl]-N-[(4-methoxyphenyl)methyl]-2-(3-methoxypropylamino)acetamide
InChI=1S/C24H31N3O3/c1-29-15-5-13-25-17-24(28)27(18-19-8-10-21(30-2)11-9-19)14-12-20-16-26-23-7-4-3-6-22(20)23/h3-4,6-11,16,25-26H,5,12-15,17-18H2,1-2H3
FCUFKQPLMXGHLZ-UHFFFAOYSA-N
COCCCNCC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=C(C=C3)OC
C24H31N3O3
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
409.5 g/mol
Property Name
XLogP3-AA
Property Value
3.1
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
4
Property Name
Rotatable Bond Count
Property Value
12
Property Name
Exact Mass
Property Value
409.23654186 g/mol
Property Name
Monoisotopic Mass
Property Value
409.23654186 g/mol
Property Name
Topological Polar Surface Area
Property Value
66.6 A^2
Property Name
Heavy Atom Count
Property Value
30
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
496
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