Home Other Building Blocks (4R)-4-[3-(cyclopentyloxy)-4-methoxyphenyl]pyrrolidin-2-one

(4R)-4-[3-(cyclopentyloxy)-4-methoxyphenyl]pyrrolidin-2-one

CAS No.:
85416-75-7
Catalog Number:
AG0036EM
Molecular Formula:
C16H21NO3
Molecular Weight:
275.3428
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
1 week
United States
$73
- +
250mg
98%
1 week
United States
$109
- +
Product Description
Catalog Number:
AG0036EM
Chemical Name:
(4R)-4-[3-(cyclopentyloxy)-4-methoxyphenyl]pyrrolidin-2-one
CAS Number:
85416-75-7
Molecular Formula:
C16H21NO3
Molecular Weight:
275.3428
MDL Number:
MFCD03093860
IUPAC Name:
(4R)-4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidin-2-one
InChI:
InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m0/s1
InChI Key:
HJORMJIFDVBMOB-LBPRGKRZSA-N
SMILES:
COc1ccc(cc1OC1CCCC1)[C@@H]1CNC(=O)C1
UNII:
DPX51KUP08
Properties
Complexity:
341  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
275.152g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
275.348g/mol
Monoisotopic Mass:
275.152g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Dual β2-adrenoceptor agonists-PDE4 inhibitors for the treatment of asthma and COPD. Bioorganic & medicinal chemistry letters 20120215
SAR of a series of 5,6-dihydro-(9H)-pyrazolo[3,4-c]-1,2,4-triazolo[4,3-alpha]pyridines as potent inhibitors of human eosinophil phosphodiesterase. Journal of medicinal chemistry 20070125
Synthesis and evaluation of N-aryl pyrrolidinones as novel anti-HIV-1 agents. Part 1. Bioorganic & medicinal chemistry letters 20060701
Three-dimensional structures of PDE4D in complex with roliprams and implication on inhibitor selectivity. Structure (London, England : 1993) 20030701
Crystal structure of 5-t-butoxycarbonyl-1-benzoyl-2-pyrrolidinone, an intermediate in the synthesis of (-)-rolipram. Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20020701
Novel selective PDE4 inhibitors. 3. In vivo antiinflammatory activity of a new series of N-substituted cis-tetra- and cis-hexahydrophthalazinones. Journal of medicinal chemistry 20020606
Novel selective PDE4 inhibitors. 2. Synthesis and structure-activity relationships of 4-aryl-substituted cis-tetra- and cis-hexahydrophthalazinones. Journal of medicinal chemistry 20010802
Properties