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88013-16-5 | Acetamide, N-methyl-N-(6-phenylimidazo[2,1-b]-1,3,4-thiadiazol-2-yl)-
CAS No: 88013-16-5 Catalog No: AG004JUT MDL No:
Product Description
Catalog Number:
AG004JUT
Chemical Name:
Acetamide, N-methyl-N-(6-phenylimidazo[2,1-b]-1,3,4-thiadiazol-2-yl)-
CAS Number:
88013-16-5
Molecular Formula:
C13H12N4OS
Molecular Weight:
272.3256
IUPAC Name:
N-methyl-N-(6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)acetamide
InChI:
InChI=1S/C13H12N4OS/c1-9(18)16(2)13-15-17-8-11(14-12(17)19-13)10-6-4-3-5-7-10/h3-8H,1-2H3
InChI Key:
VNXKIZHXYGTSQM-UHFFFAOYSA-N
SMILES:
CC(=O)N(c1nn2c(s1)nc(c2)c1ccccc1)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.073g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.326g/mol
Monoisotopic Mass:
272.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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