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LJI308

CAS No.:
1627709-94-7
Catalog Number:
AG00ABPQ
Molecular Formula:
C21H18F2N2O2
Molecular Weight:
368.3766
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$105
- +
5mg
≥98%
1 week
United States
$276
- +
10mg
≥98%
1 week
United States
$446
- +
25mg
≥98%
1 week
United States
$908
- +
50mg
99%
1 week
United States
$1707
- +
100mg
99%
1 week
United States
$2807
- +
Product Description
Catalog Number:
AG00ABPQ
Chemical Name:
LJI308
CAS Number:
1627709-94-7
Molecular Formula:
C21H18F2N2O2
Molecular Weight:
368.3766
MDL Number:
MFCD29905461
IUPAC Name:
2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)pyridin-3-yl]phenol
InChI:
InChI=1S/C21H18F2N2O2/c22-19-11-15(12-20(23)21(19)26)18-13-24-6-5-17(18)14-1-3-16(4-2-14)25-7-9-27-10-8-25/h1-6,11-13,26H,7-10H2
InChI Key:
YUYJEQHNWKQNBT-UHFFFAOYSA-N
SMILES:
Oc1c(F)cc(cc1F)c1cnccc1c1ccc(cc1)N1CCOCC1
Properties
Complexity:
457  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.134g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
368.384g/mol
Monoisotopic Mass:
368.134g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Physiological study of ergot: induction of alkaloid synthesis by tryptophan at the enzymatic level. Journal of bacteriology 19760101
Properties