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Dgat1-in-1

CAS No.:
1449779-49-0
Catalog Number:
AG00ABNM
Molecular Formula:
C30H28F3N3O4
Molecular Weight:
551.5562
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
95%
1 week
United States
$265
- +
10mg
95%
1 week
United States
$404
- +
50mg
95%
1 week
United States
$1098
- +
100mg
95%
1 week
United States
$1793
- +
Product Description
Catalog Number:
AG00ABNM
Chemical Name:
Dgat1-in-1
CAS Number:
1449779-49-0
Molecular Formula:
C30H28F3N3O4
Molecular Weight:
551.5562
MDL Number:
MFCD28167832
IUPAC Name:
2-[4-[4-[2-[[4-(trifluoromethoxy)phenyl]methylcarbamoyl]imidazo[1,2-a]pyridin-6-yl]phenyl]cyclohexyl]acetic acid
InChI:
InChI=1S/C30H28F3N3O4/c31-30(32,33)40-25-12-3-20(4-13-25)16-34-29(39)26-18-36-17-24(11-14-27(36)35-26)23-9-7-22(8-10-23)21-5-1-19(2-6-21)15-28(37)38/h3-4,7-14,17-19,21H,1-2,5-6,15-16H2,(H,34,39)(H,37,38)
InChI Key:
KFGSQOIWOCDWAS-UHFFFAOYSA-N
SMILES:
OC(=O)C[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc2n(c1)cc(n2)C(=O)NCc1ccc(cc1)OC(F)(F)F
Properties
Complexity:
850  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
551.203g/mol
Formal Charge:
0
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
551.566g/mol
Monoisotopic Mass:
551.203g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4  
Properties