sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks GRA Ex-25

GRA Ex-25

CAS No.:
307983-31-9
Catalog Number:
AG00BJZH
Molecular Formula:
C29H36F3N3O5
Molecular Weight:
563.6084
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
2mg
99%
1 week
United States
$190
- +
5mg
99%
1 week
United States
$307
- +
10mg
99%
1 week
United States
$407
- +
50mg
99%
1 week
United States
$1223
- +
100mg
99%
1 week
United States
$2057
- +
Product Description
Catalog Number:
AG00BJZH
Chemical Name:
GRA Ex-25
CAS Number:
307983-31-9
Molecular Formula:
C29H36F3N3O5
Molecular Weight:
563.6084
MDL Number:
MFCD11977277
IUPAC Name:
3-[[4-[[(4-tert-butylcyclohexyl)-[[4-(trifluoromethoxy)phenyl]carbamoyl]amino]methyl]benzoyl]amino]propanoic acid
InChI:
InChI=1S/C29H36F3N3O5/c1-28(2,3)21-8-12-23(13-9-21)35(27(39)34-22-10-14-24(15-11-22)40-29(30,31)32)18-19-4-6-20(7-5-19)26(38)33-17-16-25(36)37/h4-7,10-11,14-15,21,23H,8-9,12-13,16-18H2,1-3H3,(H,33,38)(H,34,39)(H,36,37)
InChI Key:
BZXMLCVDKDXRQY-UHFFFAOYSA-N
SMILES:
OC(=O)CCNC(=O)c1ccc(cc1)CN(C(=O)Nc1ccc(cc1)OC(F)(F)F)[C@@H]1CC[C@H](CC1)C(C)(C)C
Properties
Complexity:
839  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
563.261g/mol
Formal Charge:
0
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
563.618g/mol
Monoisotopic Mass:
563.261g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8  
Literature
Title Journal
Discovery of novel, potent, selective, and orally active human glucagon receptor antagonists containing a pyrazole core. Bioorganic & medicinal chemistry letters 20110101
Novel glucagon receptor antagonists with improved selectivity over the glucose-dependent insulinotropic polypeptide receptor. Journal of medicinal chemistry 20080911
New beta-alanine derivatives are orally available glucagon receptor antagonists. Journal of medicinal chemistry 20070111
Discovery of novel, potent, and orally active spiro-urea human glucagon receptor antagonists. Bioorganic & medicinal chemistry letters 20051015
Biaryl amide glucagon receptor antagonists. Bioorganic & medicinal chemistry letters 20040503
Properties