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190193-10-3 | Acetamide, 2-bromo-N-[(4-fluorophenyl)methyl]-
CAS No: 190193-10-3 Catalog No: AG002EDV MDL No:MFCD16487644
Product Description
Catalog Number:
AG002EDV
Chemical Name:
Acetamide, 2-bromo-N-[(4-fluorophenyl)methyl]-
CAS Number:
190193-10-3
Molecular Formula:
C9H9BrFNO
Molecular Weight:
246.0763
MDL Number:
MFCD16487644
IUPAC Name:
2-bromo-N-[(4-fluorophenyl)methyl]acetamide
InChI:
InChI=1S/C9H9BrFNO/c10-5-9(13)12-6-7-1-3-8(11)4-2-7/h1-4H,5-6H2,(H,12,13)
InChI Key:
VNUCVEHCJZCMDP-UHFFFAOYSA-N
SMILES:
BrCC(=O)NCc1ccc(cc1)F
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.985g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.079g/mol
Monoisotopic Mass:
244.985g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| An allosteric potentiator of M4 mAChR modulates hippocampal synaptic transmission. | Nature chemical biology 20080101 |
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