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Gosogliptin hydrochloride

CAT: 0013-GTR19273527-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19273527-01Size:50 mg
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Description
Gosogliptin hydrochloride is the hydrochloride salt of Gosogliptin. Gosogliptin (PF-00734200) is a potent, orally active selective competitive inhibitor of DPP-IV, which is primarily responsible for degrading the incretin hormones GLP-1 and glucose-dependent insulinotropic polypeptide. Gosogliptin rapidly and reversibly inhibits plasma DPP-4 activity, stimulates insulin secretion, and improves glucose tolerance.
CAS Number
869490-47-1
Smiles
O=C (N1CC (F) (CC1) F) [C@@H]2C[C@H] (N3CCN (C4=NC=CC=N4) CC3) CN2.Cl.Cl
Molecular Formula
C17H26Cl2F2N6O
Molecular Weight
439.33
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Gosogliptin

Gosogliptin is an amino acid amide.

CAS Number869490-47-1
PubChem CID11516136
IUPAC Name(3,3-difluoropyrrolidin-1-yl)-[(2S,4S)-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrolidin-2-yl]methanone
Molecular FormulaC17H24F2N6O
Molecular Weight366.4
XLogP0.6
Topological Polar Surface Area64.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity507
SMILES
C1CN(CC1(F)F)C(=O)[C@@H]2C[C@@H](CN2)N3CCN(CC3)C4=NC=CC=N4
InChI
InChI=1S/C17H24F2N6O/c18-17(19)2-5-25(12-17)15(26)14-10-13(11-22-14)23-6-8-24(9-7-23)16-20-3-1-4-21-16/h1,3-4,13-14,22H,2,5-12H2/t13-,14-/m0/s1
InChIKey
QWEWGXUTRTXFRF-KBPBESRZSA-N
Chemical Structure
2D Structure
2D structure of Gosogliptin
CAS: 869490-47-1
CID: 11516136
Formula: C17H24F2N6O
MW: 366.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight366.4
XLogP30.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass366.19796573
Monoisotopic Mass366.19796573
Topological Polar Surface Area64.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity507
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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