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87035-05-0 | 3H-Imidazo[4,5-c]pyridine, 3-methyl-4-[(1-naphthalenylmethyl)thio]-
CAS No: 87035-05-0 Catalog No: AG004GMS MDL No:
Product Description
Catalog Number:
AG004GMS
Chemical Name:
3H-Imidazo[4,5-c]pyridine, 3-methyl-4-[(1-naphthalenylmethyl)thio]-
CAS Number:
87035-05-0
Molecular Formula:
C18H15N3S
Molecular Weight:
305.3968
IUPAC Name:
3-methyl-4-(naphthalen-1-ylmethylsulfanyl)imidazo[4,5-c]pyridine
InChI:
InChI=1S/C18H15N3S/c1-21-12-20-16-9-10-19-18(17(16)21)22-11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10,12H,11H2,1H3
InChI Key:
YGFBDQFUGIPOKI-UHFFFAOYSA-N
SMILES:
Cn1cnc2c1c(ncc2)SCc1cccc2c1cccc2
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.099g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.399g/mol
Monoisotopic Mass:
305.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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