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ML364

CAS No.:
1991986-30-1
Catalog Number:
AG00AS5B
Molecular Formula:
C24H18F3N3O3S2
Molecular Weight:
517.5432
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$93
- +
5mg
99%
1 week
United States
$161
- +
10mg
99%
1 week
United States
$223
- +
25mg
≥98%
1 week
United States
$508
- +
50mg
99%
1 week
United States
$779
- +
100mg
99%
1 week
United States
$1279
- +
Product Description
Catalog Number:
AG00AS5B
Chemical Name:
ML364
CAS Number:
1991986-30-1
Molecular Formula:
C24H18F3N3O3S2
Molecular Weight:
517.5432
MDL Number:
MFCD30718174
IUPAC Name:
2-[(4-methylphenyl)sulfonylamino]-N-(4-phenyl-1,3-thiazol-2-yl)-4-(trifluoromethyl)benzamide
InChI:
InChI=1S/C24H18F3N3O3S2/c1-15-7-10-18(11-8-15)35(32,33)30-20-13-17(24(25,26)27)9-12-19(20)22(31)29-23-28-21(14-34-23)16-5-3-2-4-6-16/h2-14,30H,1H3,(H,28,29,31)
InChI Key:
QZUGMNXETPARLI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)Nc1cc(ccc1C(=O)Nc1scc(n1)c1ccccc1)C(F)(F)F
Properties
Complexity:
822  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
517.074g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
517.541g/mol
Monoisotopic Mass:
517.074g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1  
Properties