Products for Research Use Only
RegisterLogin

Carmegliptin dihydrochloride

CAT: 0931-T68652-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T68652-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
813452-14-1
Target
Others
Related Pathways
Others
Bioactivity
Carmegliptin dihydrochloride is the salt form of Camegliptin (free base), also known as RG-1579 and RO4876904, a dipeptidyl peptidase IV (DPP-4) inhibitor potentially for the treatment of type 2 diabetes.
Smiles
Cl.Cl.[H][C@@]12C[C@H](N)[C@H](CN1CCc1cc(OC)c(OC)cc21)N1C[C@@H](CF)CC1=O
Molecular Formula
C20H30Cl2FN3O3
Molecular Weight
450.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Carmegliptin Dihydrochloride

Carmegliptin Dihydrochloride is the dihydrochloride salt form of carmegliptin, a potent, long-acting, selective, orally bioavailable, pyrrolidinone-based inhibitor of dipeptidyl peptidase 4 (DPP-4), with hypoglycemic activity. Carmegliptin shows extensive tissue distribution and is excreted unchanged in the urine and bile.

CAS Number813452-14-1
PubChem CID25094880
IUPAC Name(4S)-1-[(2S,3S,11bS)-2-amino-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-3-yl]-4-(fluoromethyl)pyrrolidin-2-one;dihydrochloride
Molecular FormulaC20H30Cl2FN3O3
Molecular Weight450.4
Topological Polar Surface Area68
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity551
SMILES
COC1=C(C=C2[C@@H]3C[C@@H]([C@H](CN3CCC2=C1)N4C[C@H](CC4=O)CF)N)OC.Cl.Cl
InChI
InChI=1S/C20H28FN3O3.2ClH/c1-26-18-6-13-3-4-23-11-17(24-10-12(9-21)5-20(24)25)15(22)8-16(23)14(13)7-19(18)27-2;;/h6-7,12,15-17H,3-5,8-11,22H2,1-2H3;2*1H/t12-,15+,16+,17+;;/m1../s1
InChIKey
DDKJYXSAKVWFLS-LSKWAPIISA-N
Chemical Structure
2D Structure
2D structure of Carmegliptin Dihydrochloride
CAS: 813452-14-1
CID: 25094880
Formula: C20H30Cl2FN3O3
MW: 450.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight450.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass449.1648254
Monoisotopic Mass449.1648254
Topological Polar Surface Area68 Ų
Heavy Atom Count29
Formal Charge0
Complexity551
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

Related Products

CatalogName
T20109-01Cystamine dihydrochloride
T23122PB28 dihydrochloride
T39194PLX647 dihydrochloride
T22802-01GNTI dihydrochloride
T23177PPACK Dihydrochloride
T212318-01Tuspetinib dihydrochloride
T203225-01Clozapine dihydrochloride
T0194L2-01Chloroquine dihydrochloride
T89001-01Lisavanbulin dihydrochloride
T88235-01Pracinostat dihydrochloride

Alternative Products

CatalogName
MBS5811212Carmegliptin dihydrochloride
HY-10289Carmegliptin
OR1013406-01Formamidine disulfide dihydrochloride Disulfide Dihydrochloride
A15150-2Merestinib dihydrochloride (LY2801653 dihydrochloride) 2mg
MBS130300-01Mirodenafil-dihydrochloride, SK-3530 dihydrochloride
A21622-50Iadademstat dihydrochloride (ORY-1001 dihydrochloride) 50mg
A21622-1Iadademstat dihydrochloride (ORY-1001 dihydrochloride) 1mg
25523156Putrescine dihydrochloride (1,4-Diaminobutane dihydrochloride)
4325-01PUTRESCINE DIHYDROCHLORIDE (1,4-Butanediamine dihydrochloride)
MBS130388-01TAS 103 dihydrochloride, BMS 247615 dihydrochloride

Popular Products