CID 39120331
PubChem CID
39120331
Structure
Molecular Formula
Status
Non-live
Molecular Weight
308.74 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
2-[6-chloro-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetate
InChI=1S/C14H16ClN3O3/c15-10-1-2-13-16-11(7-14(19)20)12(18(13)8-10)9-17-3-5-21-6-4-17/h1-2,8H,3-7,9H2,(H,19,20)/p-1
JHCNYMDTRSUNQP-UHFFFAOYSA-M
C1COCCN1CC2=C(N=C3N2C=C(C=C3)Cl)CC(=O)[O-]
C14H15ClN3O3-
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
308.74 g/mol
Property Name
XLogP3-AA
Property Value
-0.2
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
5
Property Name
Rotatable Bond Count
Property Value
3
Property Name
Exact Mass
Property Value
308.0801940 g/mol
Property Name
Monoisotopic Mass
Property Value
308.0801940 g/mol
Property Name
Topological Polar Surface Area
Property Value
69.9 A^2
Property Name
Heavy Atom Count
Property Value
21
Property Name
Formal Charge
Property Value
-1
Property Name
Complexity
Property Value
373
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
CONTENTS