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Home Other Building Blocks N-4-Methoxyphenylretinamide

N-4-Methoxyphenylretinamide

CAS No.:
79965-10-9
Catalog Number:
AG008KR0
Molecular Formula:
C27H35NO2
Molecular Weight:
405.5723
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Product Description
Catalog Number:
AG008KR0
Chemical Name:
N-4-Methoxyphenylretinamide
CAS Number:
79965-10-9
Molecular Formula:
C27H35NO2
Molecular Weight:
405.5723
MDL Number:
MFCD00870699
IUPAC Name:
(2E,4E,6E,8E)-N-(4-methoxyphenyl)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenamide
InChI:
InChI=1S/C27H35NO2/c1-20(12-17-25-22(3)11-8-18-27(25,4)5)9-7-10-21(2)19-26(29)28-23-13-15-24(30-6)16-14-23/h7,9-10,12-17,19H,8,11,18H2,1-6H3,(H,28,29)/b10-7+,17-12+,20-9+,21-19+
InChI Key:
DBQHWMPFMCOGIW-ABRSJASVSA-N
SMILES:
COc1ccc(cc1)NC(=O)/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C
NSC Number:
743413
Properties
Complexity:
741  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
4  
Exact Mass:
405.267g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
405.582g/mol
Monoisotopic Mass:
405.267g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6  
Literature
Title Journal
Fenretinide derivatives act as disrupters of interactions of serum retinol binding protein (sRBP) with transthyretin and the sRBP receptor. Journal of medicinal chemistry 20110714
Characterization of the metabolism of fenretinide by human liver microsomes, cytochrome P450 enzymes and UDP-glucuronosyltransferases. British journal of pharmacology 20110201
Design and synthesis of 4-HPR derivatives for rhabdoid tumors. Bioorganic & medicinal chemistry letters 20080701
Solid phase-assisted synthesis and screening of a small library of N-(4-hydroxyphenyl)retinamide (4-HPR) analogs. Bioorganic & medicinal chemistry letters 20070201
Chemoprevention of skin carcinogenesis by phenylretinamides: retinoid receptor-independent tumor suppression. Clinical cancer research : an official journal of the American Association for Cancer Research 20060201
Liquid chromatography method for quantifying N-(4-hydroxyphenyl)retinamide and N-(4-methoxyphenyl)retinamide in tissues. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20040905
Properties