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119628-83-0 | 3H-Imidazo[4,5-b]pyridine, 2-cyclopentyl-
CAS No: 119628-83-0 Catalog No: AG000PDI MDL No:
Product Description
Catalog Number:
AG000PDI
Chemical Name:
3H-Imidazo[4,5-b]pyridine, 2-cyclopentyl-
CAS Number:
119628-83-0
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
IUPAC Name:
2-cyclopentyl-1H-imidazo[4,5-b]pyridine
InChI:
InChI=1S/C11H13N3/c1-2-5-8(4-1)10-13-9-6-3-7-12-11(9)14-10/h3,6-8H,1-2,4-5H2,(H,12,13,14)
InChI Key:
DHCJZAGWHJCYOH-UHFFFAOYSA-N
SMILES:
C1CCC(C1)c1nc2c([nH]1)nccc2
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.246g/mol
Monoisotopic Mass:
187.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| 2,6,8-trisubstituted 1-deazapurines as adenosine receptor antagonists. | Journal of medicinal chemistry 20070222 |
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