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Home Other Building Blocks Tipifarnib S-Enantiomer

Tipifarnib S-Enantiomer

CAS No.:
192185-71-0
Catalog Number:
AG00ABP9
Molecular Formula:
C27H22Cl2N4O
Molecular Weight:
489.3958
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$354
- +
10mg
99%
1 week
United States
$540
- +
50mg
99%
1 week
United States
$1357
- +
Product Description
Catalog Number:
AG00ABP9
Chemical Name:
Tipifarnib S-Enantiomer
CAS Number:
192185-71-0
Molecular Formula:
C27H22Cl2N4O
Molecular Weight:
489.3958
MDL Number:
MFCD09837802
IUPAC Name:
6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(3-chlorophenyl)-1-methylquinolin-2-one
InChI:
InChI=1S/C27H22Cl2N4O/c1-32-16-31-15-25(32)27(30,18-6-9-20(28)10-7-18)19-8-11-24-23(13-19)22(14-26(34)33(24)2)17-4-3-5-21(29)12-17/h3-16H,30H2,1-2H3/t27-/m0/s1
InChI Key:
PLHJCIYEEKOWNM-MHZLTWQESA-N
SMILES:
Clc1ccc(cc1)[C@@](c1cncn1C)(c1ccc2c(c1)c(cc(=O)n2C)c1cccc(c1)Cl)N
Properties
Complexity:
785  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
488.117g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
489.4g/mol
Monoisotopic Mass:
488.117g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
Toward the development of innovative bifunctional agents to induce differentiation and to promote apoptosis in leukemia: clinical candidates and perspectives. Journal of medicinal chemistry 20101014
Rational modification of a candidate cancer drug for use against Chagas disease. Journal of medicinal chemistry 20090326
Impact on farnesyltransferase inhibition of 4-chlorophenyl moiety replacement in the Zarnestra series. European journal of medicinal chemistry 20070501
Properties