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1325681-83-1 | 1H-Indazole-3-carboxamide, 1-(3-methylbenzoyl)-N-phenyl-
CAS No: 1325681-83-1 Catalog No: AG0010UM MDL No:
Product Description
Catalog Number:
AG0010UM
Chemical Name:
1H-Indazole-3-carboxamide, 1-(3-methylbenzoyl)-N-phenyl-
CAS Number:
1325681-83-1
Molecular Formula:
C22H17N3O2
Molecular Weight:
355.3893
IUPAC Name:
1-(3-methylbenzoyl)-N-phenylindazole-3-carboxamide
InChI:
InChI=1S/C22H17N3O2/c1-15-8-7-9-16(14-15)22(27)25-19-13-6-5-12-18(19)20(24-25)21(26)23-17-10-3-2-4-11-17/h2-14H,1H3,(H,23,26)
InChI Key:
HQOZHIXUCOLRTC-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C(=O)n1nc(c2c1cccc2)C(=O)Nc1ccccc1
Properties
Complexity:
546
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.132g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
355.397g/mol
Monoisotopic Mass:
355.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| Design, synthesis and evaluation of N-benzoylindazole derivatives and analogues as inhibitors of human neutrophil elastase. | Bioorganic & medicinal chemistry 20110801 |
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