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Gdc-0810

CAS No.:
1365888-06-7
Catalog Number:
AG00123J
Molecular Formula:
C26H20ClFN2O2
Molecular Weight:
446.9006
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$257
- +
10mg
99%
1 week
United States
$357
- +
50mg
99%
1 week
United States
$857
- +
100mg
99%
1 week
United States
$1140
- +
Product Description
Catalog Number:
AG00123J
Chemical Name:
Gdc-0810
CAS Number:
1365888-06-7
Molecular Formula:
C26H20ClFN2O2
Molecular Weight:
446.9006
MDL Number:
MFCD28902190
IUPAC Name:
(E)-3-[4-[(E)-2-(2-chloro-4-fluorophenyl)-1-(1H-indazol-5-yl)but-1-enyl]phenyl]prop-2-enoic acid
InChI:
InChI=1S/C26H20ClFN2O2/c1-2-21(22-10-9-20(28)14-23(22)27)26(18-8-11-24-19(13-18)15-29-30-24)17-6-3-16(4-7-17)5-12-25(31)32/h3-15H,2H2,1H3,(H,29,30)(H,31,32)/b12-5+,26-21+
InChI Key:
BURHGPHDEVGCEZ-KJGLQBJMSA-N
SMILES:
CC/C(=C(\c1ccc2c(c1)cn[nH]2)/c1ccc(cc1)/C=C/C(=O)O)/c1ccc(cc1Cl)F
UNII:
9MM2R1A06R
Properties
Complexity:
719  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2  
Exact Mass:
446.12g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
446.906g/mol
Monoisotopic Mass:
446.12g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4  
Properties