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gamma-secretase modulator 3

CAS No.:
1431697-84-5
Catalog Number:
AG009CBP
Molecular Formula:
C24H23FN4OS
Molecular Weight:
434.5290
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
99%
1 week
United States
$473
- +
100mg
99%
1 week
United States
$1446
- +
Product Description
Catalog Number:
AG009CBP
Chemical Name:
gamma-secretase modulator 3
CAS Number:
1431697-84-5
Molecular Formula:
C24H23FN4OS
Molecular Weight:
434.5290
MDL Number:
MFCD23380596
IUPAC Name:
4-(4-fluorophenyl)-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C24H23FN4OS/c1-15-13-29(14-26-15)20-11-10-18(12-21(20)30-2)27-24-28-23-19(4-3-5-22(23)31-24)16-6-8-17(25)9-7-16/h6-14,19H,3-5H2,1-2H3,(H,27,28)
InChI Key:
UCGDOBMXNQTSSO-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1n1cnc(c1)C)Nc1nc2c(s1)CCCC2c1ccc(cc1)F
Properties
Complexity:
592  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
434.158g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
434.533g/mol
Monoisotopic Mass:
434.158g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6  
Properties