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15821-13-3 | 4-Quinolinecarboxamide, 2-methyl-
CAS No: 15821-13-3 Catalog No: AG001Q2I MDL No:MFCD00023982
Product Description
Catalog Number:
AG001Q2I
Chemical Name:
4-Quinolinecarboxamide, 2-methyl-
CAS Number:
15821-13-3
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD00023982
IUPAC Name:
2-methylquinoline-4-carboxamide
InChI:
InChI=1S/C11H10N2O/c1-7-6-9(11(12)14)8-4-2-3-5-10(8)13-7/h2-6H,1H3,(H2,12,14)
InChI Key:
GPTOAZYKFYMYMW-UHFFFAOYSA-N
SMILES:
Cc1nc2ccccc2c(c1)C(=O)N
EC Number:
239-917-8
NSC Number:
81239
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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