NVP-DPP-728 DIHYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H18N6O.2ClH
Molecular Weight	371.265
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of NVP-DPP-728 DIHYDROCHLORIDE

Structure Search

SMILES

Cl.Cl.O=C(CNCCNC1=NC=C(C=C1)C#N)N2CCC[C@H]2C#N

InChI

InChIKey=VNACOBVZDCLAEV-GXKRWWSZSA-N

InChI=1S/C15H18N6O.2ClH/c16-8-12-3-4-14(20-10-12)19-6-5-18-11-15(22)21-7-1-2-13(21)9-17;;/h3-4,10,13,18H,1-2,5-7,11H2,(H,19,20);2*1H/t13-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula	C15H18N6O
Molecular Weight	298.343
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Dipeptidyl peptidase IV 37 Target ID: CHEMBL284 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10512614	Inhibitor 8297		11.0 nM [Ki]
Dipeptidyl peptidase IV 37 Target ID: CHEMBL284 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10512614	Inhibitor 8297		11.0 nM [Ki]

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:07:02 GMT 2023` Edited by `admin` on `Fri Dec 15 16:07:02 GMT 2023`
Record UNII	PWKTKAMJUR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NVP-DPP-728 DIHYDROCHLORIDE

Code

English

DPP-728

Code

English

2-PYRROLIDINECARBONITRILE, 1-(((2-((5-CYANO-2-PYRIDINYL)AMINO)ETHYL)AMINO)ACETYL)-, DIHYDROCHLORIDE, (2S)-

Systematic Name

English

1-(2-((5-CYANO-2-PYRIDINYL)AMINO)ETHYLAMINO)ACETYL-2-PYRROLIDINECARBONITRILE DIHYDROCHLORIDE, (2S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9799555

Created by admin on Fri Dec 15 16:07:02 GMT 2023 , Edited by admin on Fri Dec 15 16:07:02 GMT 2023

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FDA UNII

PWKTKAMJUR

Created by admin on Fri Dec 15 16:07:02 GMT 2023 , Edited by admin on Fri Dec 15 16:07:02 GMT 2023

PRIMARY

CAS

207556-62-5

Created by admin on Fri Dec 15 16:07:02 GMT 2023 , Edited by admin on Fri Dec 15 16:07:02 GMT 2023

PRIMARY

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					HCX5M1YIOM

NVP-DPP-728

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					PWKTKAMJUR

NVP-DPP-728 DIHYDROCHLORIDE

ACTIVE MOIETY

Comments:

Potent, orally active dipeptidyl peptidase (DPP)-IV inhibitor (Ki = 11 nM, IC50 = 14 nM) that displays > 15 000-fold selectivity over DPP-II and a range of proline-cleaving proteases. Exhibits antidiabetic activity in vivo improves glucose tolerance, increases glucagon-like peptide 1 (GLP-1) and insulin levels, augments insulin secretion and GLUT2 levels, and reduces (preserves) islet size.