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501661-67-2 | 1H-Benzimidazole, 2-(4-methyl-1,2,3-thiadiazol-5-yl)-
CAS No: 501661-67-2 Catalog No: AG006VU1 MDL No:
Product Description
Catalog Number:
AG006VU1
Chemical Name:
1H-Benzimidazole, 2-(4-methyl-1,2,3-thiadiazol-5-yl)-
CAS Number:
501661-67-2
Molecular Formula:
C10H8N4S
Molecular Weight:
216.2623
IUPAC Name:
5-(1H-benzimidazol-2-yl)-4-methylthiadiazole
InChI:
InChI=1S/C10H8N4S/c1-6-9(15-14-13-6)10-11-7-4-2-3-5-8(7)12-10/h2-5H,1H3,(H,11,12)
InChI Key:
FWZDEPFNQLNFON-UHFFFAOYSA-N
SMILES:
Cc1nnsc1c1nc2c([nH]1)cccc2
NSC Number:
332453
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.047g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.262g/mol
Monoisotopic Mass:
216.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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