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148612-12-8 | Butanamide, N-(5-bromo-2-pyridinyl)-
CAS No: 148612-12-8 Catalog No: AG001L2F MDL No:MFCD02210530
Product Description
Catalog Number:
AG001L2F
Chemical Name:
Butanamide, N-(5-bromo-2-pyridinyl)-
CAS Number:
148612-12-8
Molecular Formula:
C9H11BrN2O
Molecular Weight:
243.1004
MDL Number:
MFCD02210530
IUPAC Name:
N-(5-bromopyridin-2-yl)butanamide
InChI:
InChI=1S/C9H11BrN2O/c1-2-3-9(13)12-8-5-4-7(10)6-11-8/h4-6H,2-3H2,1H3,(H,11,12,13)
InChI Key:
GPUHGOJHYYRRJH-UHFFFAOYSA-N
SMILES:
CCCC(=O)Nc1ccc(cn1)Br
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.005g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.104g/mol
Monoisotopic Mass:
242.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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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