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1627710-50-2

CAS No.:
1627710-50-2
Catalog Number:
AG00ABSN
Molecular Formula:
C22H21F2N3O
Molecular Weight:
381.4184
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$91
- +
5mg
≥98%
1 week
United States
$187
- +
10mg
≥98%
1 week
United States
$300
- +
25mg
≥98%
1 week
United States
$578
- +
50mg
99%
1 week
United States
$1057
- +
100mg
99%
1 week
United States
$1890
- +
Product Description
Catalog Number:
AG00ABSN
Chemical Name:
1627710-50-2
CAS Number:
1627710-50-2
Molecular Formula:
C22H21F2N3O
Molecular Weight:
381.4184
MDL Number:
MFCD29924738
IUPAC Name:
2,6-difluoro-4-[4-[4-(4-methylpiperazin-1-yl)phenyl]pyridin-3-yl]phenol
InChI:
InChI=1S/C22H21F2N3O/c1-26-8-10-27(11-9-26)17-4-2-15(3-5-17)18-6-7-25-14-19(18)16-12-20(23)22(28)21(24)13-16/h2-7,12-14,28H,8-11H2,1H3
InChI Key:
IKUFKDGKRLMXEX-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1ccc(cc1)c1ccncc1c1cc(F)c(c(c1)F)O
UNII:
27CZQ807C1
Properties
Complexity:
482  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.165g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
381.427g/mol
Monoisotopic Mass:
381.165g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties