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87035-32-3 | 1H-Imidazo[4,5-c]pyridine, 4-[[(2-chlorophenyl)methyl]thio]-1-ethyl-
CAS No: 87035-32-3 Catalog No: AG004GMJ MDL No:
Product Description
Catalog Number:
AG004GMJ
Chemical Name:
1H-Imidazo[4,5-c]pyridine, 4-[[(2-chlorophenyl)methyl]thio]-1-ethyl-
CAS Number:
87035-32-3
Molecular Formula:
C15H14ClN3S
Molecular Weight:
303.8098
IUPAC Name:
4-[(2-chlorophenyl)methylsulfanyl]-1-ethylimidazo[4,5-c]pyridine
InChI:
InChI=1S/C15H14ClN3S/c1-2-19-10-18-14-13(19)7-8-17-15(14)20-9-11-5-3-4-6-12(11)16/h3-8,10H,2,9H2,1H3
InChI Key:
ADSZNHZBBFRUJQ-UHFFFAOYSA-N
SMILES:
CCn1cnc2c1ccnc2SCc1ccccc1Cl
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.06g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.808g/mol
Monoisotopic Mass:
303.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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