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Home > Imidazoles > 784082-29-7
784082-29-7 | Imidazo[1,5-a]pyrazine-8(7H)-thione, 3-methyl- (9CI)
CAS No: 784082-29-7 Catalog No: AG005BE8 MDL No:
Product Description
Catalog Number:
AG005BE8
Chemical Name:
Imidazo[1,5-a]pyrazine-8(7H)-thione, 3-methyl- (9CI)
CAS Number:
784082-29-7
Molecular Formula:
C7H7N3S
Molecular Weight:
165.2156
IUPAC Name:
3-methyl-7H-imidazo[1,5-a]pyrazine-8-thione
InChI:
InChI=1S/C7H7N3S/c1-5-9-4-6-7(11)8-2-3-10(5)6/h2-4H,1H3,(H,8,11)
InChI Key:
QJPWQKKQBOHCAV-UHFFFAOYSA-N
SMILES:
S=c1[nH]ccn2c1cnc2C
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.036g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.214g/mol
Monoisotopic Mass:
165.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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