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1513389-11-1 | 1-cyclobutyl-1H-imidazo[4,5-c]pyridine-2-thiol
CAS No: 1513389-11-1 Catalog No: AG01DSJV MDL No:MFCD21841471
Product Description
Catalog Number:
AG01DSJV
Chemical Name:
1-cyclobutyl-1H-imidazo[4,5-c]pyridine-2-thiol
CAS Number:
1513389-11-1
Molecular Formula:
C10H11N3S
Molecular Weight:
205.2794
MDL Number:
MFCD21841471
IUPAC Name:
1-cyclobutyl-3H-imidazo[4,5-c]pyridine-2-thione
InChI:
InChI=1S/C10H11N3S/c14-10-12-8-6-11-5-4-9(8)13(10)7-2-1-3-7/h4-7H,1-3H2,(H,12,14)
InChI Key:
VMQLKJHRCQCTDO-UHFFFAOYSA-N
SMILES:
Sc1nc2c(n1C1CCC1)ccnc2
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.067g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.279g/mol
Monoisotopic Mass:
205.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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