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Home > Imidazoles > 1355236-40-6
1355236-40-6 | 5-[2-(1H-imidazol-4-yl)-1,3-thiazol-4-yl]-3-methyl-1,2,4-oxadiazole
CAS No: 1355236-40-6 Catalog No: AG019ZCI MDL No:MFCD21086729
Product Description
Catalog Number:
AG019ZCI
Chemical Name:
5-[2-(1H-imidazol-4-yl)-1,3-thiazol-4-yl]-3-methyl-1,2,4-oxadiazole
CAS Number:
1355236-40-6
Molecular Formula:
C9H7N5OS
Molecular Weight:
233.2498
MDL Number:
MFCD21086729
IUPAC Name:
5-[2-(1H-imidazol-5-yl)-1,3-thiazol-4-yl]-3-methyl-1,2,4-oxadiazole
InChI:
InChI=1S/C9H7N5OS/c1-5-12-8(15-14-5)7-3-16-9(13-7)6-2-10-4-11-6/h2-4H,1H3,(H,10,11)
InChI Key:
ZFNXMNAHNYZZNJ-UHFFFAOYSA-N
SMILES:
Cc1noc(n1)c1csc(n1)c1c[nH]cn1
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.037g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.249g/mol
Monoisotopic Mass:
233.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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