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Home Other Building Blocks 1-[1-(4-Fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-(pyrrolidin-1-yl)ethanone

1-[1-(4-Fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-(pyrrolidin-1-yl)ethanone

CAS No.:
314245-33-5
Catalog Number:
AG00C0WJ
Molecular Formula:
C18H21FN2O
Molecular Weight:
300.3705
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥98%
1 week
United States
$98
- +
10mg
≥98%
1 week
United States
$136
- +
50mg
≥98%
1 week
United States
$390
- +
100mg
≥98%
1 week
United States
$640
- +
200mg
99%
1 week
United States
$1257
- +
Product Description
Catalog Number:
AG00C0WJ
Chemical Name:
1-[1-(4-Fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-(pyrrolidin-1-yl)ethanone
CAS Number:
314245-33-5
Molecular Formula:
C18H21FN2O
Molecular Weight:
300.3705
MDL Number:
MFCD01917473
IUPAC Name:
1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone
InChI:
InChI=1S/C18H21FN2O/c1-13-11-17(18(22)12-20-9-3-4-10-20)14(2)21(13)16-7-5-15(19)6-8-16/h5-8,11H,3-4,9-10,12H2,1-2H3
InChI Key:
JUWDSDKJBMFLHE-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)n1c(C)cc(c1C)C(=O)CN1CCCC1
Properties
Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.164g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.377g/mol
Monoisotopic Mass:
300.164g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Literature
Title Journal
Vialinin A is a ubiquitin-specific peptidase inhibitor. Bioorganic & medicinal chemistry letters 20130801
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Enhancement of proteasome activity by a small-molecule inhibitor of USP14. Nature 20100909
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
Properties