Home Other Building Blocks R-268712

R-268712

CAS No.:
879487-87-3
Catalog Number:
AG00GUBH
Molecular Formula:
C20H18FN5O
Molecular Weight:
363.3882
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$290
- +
10mg
99%
1 week
United States
$407
- +
50mg
99%
1 week
United States
$1473
- +
100mg
99%
1 week
United States
$2640
- +
Product Description
Catalog Number:
AG00GUBH
Chemical Name:
R-268712
CAS Number:
879487-87-3
Molecular Formula:
C20H18FN5O
Molecular Weight:
363.3882
MDL Number:
MFCD28963939
IUPAC Name:
2-[4-[2-fluoro-5-[5-(6-methylpyridin-2-yl)-1H-pyrazol-4-yl]phenyl]pyrazol-1-yl]ethanol
InChI:
InChI=1S/C20H18FN5O/c1-13-3-2-4-19(24-13)20-17(11-22-25-20)14-5-6-18(21)16(9-14)15-10-23-26(12-15)7-8-27/h2-6,9-12,27H,7-8H2,1H3,(H,22,25)
InChI Key:
JQGOCCALXFSRHZ-UHFFFAOYSA-N
SMILES:
OCCn1ncc(c1)c1cc(ccc1F)c1cn[nH]c1c1cccc(n1)C
Properties
Complexity:
483  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.15g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
363.396g/mol
Monoisotopic Mass:
363.15g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties