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1250516-70-1 | 4-iodo-N-(pyrazin-2-yl)benzamide
CAS No: 1250516-70-1 Catalog No: AG019QN3 MDL No:MFCD14647230
Product Description
Catalog Number:
AG019QN3
Chemical Name:
4-iodo-N-(pyrazin-2-yl)benzamide
CAS Number:
1250516-70-1
Molecular Formula:
C11H8IN3O
Molecular Weight:
325.1052
MDL Number:
MFCD14647230
IUPAC Name:
4-iodo-N-pyrazin-2-ylbenzamide
InChI:
InChI=1S/C11H8IN3O/c12-9-3-1-8(2-4-9)11(16)15-10-7-13-5-6-14-10/h1-7H,(H,14,15,16)
InChI Key:
ULPASYKADJIJTN-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)C(=O)Nc1cnccn1
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.971g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
325.109g/mol
Monoisotopic Mass:
324.971g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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