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87035-22-1 | 1H-Imidazo[4,5-c]pyridine, 4-(benzo[b]thien-3-ylmethoxy)-1-propyl-
CAS No: 87035-22-1 Catalog No: AG004NJG MDL No:
Product Description
Catalog Number:
AG004NJG
Chemical Name:
1H-Imidazo[4,5-c]pyridine, 4-(benzo[b]thien-3-ylmethoxy)-1-propyl-
CAS Number:
87035-22-1
Molecular Formula:
C18H17N3OS
Molecular Weight:
323.4121
IUPAC Name:
4-(1-benzothiophen-3-ylmethoxy)-1-propylimidazo[4,5-c]pyridine
InChI:
InChI=1S/C18H17N3OS/c1-2-9-21-12-20-17-15(21)7-8-19-18(17)22-10-13-11-23-16-6-4-3-5-14(13)16/h3-8,11-12H,2,9-10H2,1H3
InChI Key:
GLNDEDNKNSDIIX-UHFFFAOYSA-N
SMILES:
CCCn1cnc2c1ccnc2OCc1csc2c1cccc2
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.109g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.414g/mol
Monoisotopic Mass:
323.109g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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