sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks Anagliptin

Anagliptin

CAS No.:
739366-20-2
Catalog Number:
AG00FC1D
Molecular Formula:
C19H25N7O2
Molecular Weight:
383.4475
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
97%
1 week
United States
$251
- +
10mg
97%
1 week
United States
$390
- +
50mg
97%
1 week
United States
$1376
- +
Product Description
Catalog Number:
AG00FC1D
Chemical Name:
Anagliptin
CAS Number:
739366-20-2
Molecular Formula:
C19H25N7O2
Molecular Weight:
383.4475
MDL Number:
MFCD19443729
IUPAC Name:
N-[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
InChI:
InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
InChI Key:
LDXYBEHACFJIEL-HNNXBMFYSA-N
SMILES:
N#C[C@@H]1CCCN1C(=O)CNC(CNC(=O)c1cnc2n(c1)nc(c2)C)(C)C
UNII:
K726J96838
Properties
Complexity:
643  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
383.207g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
383.456g/mol
Monoisotopic Mass:
383.207g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
Discovery and pharmacological characterization of N-[2-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl}amino)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide hydrochloride (anagliptin hydrochloride salt) as a potent and selective DPP-IV inhibitor. Bioorganic & medicinal chemistry 20111201
Properties