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ST271

CAS No.:
106392-48-7
Catalog Number:
AG009T7L
Molecular Formula:
C16H20N2O2
Molecular Weight:
272.3422
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$182
- +
10mg
98%
1 week
United States
$251
- +
50mg
98%
1 week
United States
$640
- +
100mg
98%
1 week
United States
$946
- +
Product Description
Catalog Number:
AG009T7L
Chemical Name:
ST271
CAS Number:
106392-48-7
Molecular Formula:
C16H20N2O2
Molecular Weight:
272.3422
MDL Number:
MFCD31544351
IUPAC Name:
(E)-2-cyano-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]prop-2-enamide
InChI:
InChI=1S/C16H20N2O2/c1-9(2)13-6-11(5-12(8-17)16(18)20)7-14(10(3)4)15(13)19/h5-7,9-10,19H,1-4H3,(H2,18,20)/b12-5+
InChI Key:
HMLQHJRJKQDTKW-LFYBBSHMSA-N
SMILES:
CC(c1cc(/C=C(/C(=O)N)\C#N)cc(c1O)C(C)C)C
Properties
Complexity:
413  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
272.152g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
272.348g/mol
Monoisotopic Mass:
272.152g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
[Tyrosine kinase inhibitor--hematological malignancies]. Gan to kagaku ryoho. Cancer & chemotherapy 20010501
Properties