N-Desmethyl,N-2(2-cyanobenzyl) Alogliptin, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H24N6O2
Molecular Weight	440.4971
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-Desmethyl,N-2(2-cyanobenzyl) Alogliptin, (S)-

Structure Search

SMILES

N[C@H]1CCCN(C1)C2=CC(=O)N(CC3=CC=CC=C3C#N)C(=O)N2CC4=CC=CC=C4C#N

InChI

InChIKey=KVIRZRAVCGZEMX-QFIPXVFZSA-N

InChI=1S/C25H24N6O2/c26-13-18-6-1-3-8-20(18)15-30-23(29-11-5-10-22(28)17-29)12-24(32)31(25(30)33)16-21-9-4-2-7-19(21)14-27/h1-4,6-9,12,22H,5,10-11,15-17,28H2/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H24N6O2
Molecular Weight	440.4971
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:39:56 GMT 2025` Edited by `admin` on `Wed Apr 02 17:39:56 GMT 2025`
Record UNII	KSZ5XRQ7WX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-Desmethyl,N-2(2-cyanobenzyl) Alogliptin, (S)-

Common Name

English

2,2?-[[6-[(3S)-3-Amino-1-piperidinyl]-2,4-dioxo-1,3(2H,4H)-pyrimidinediyl]bis(methylene)]bis[benzonitrile]

Preferred Name

English

Code System Code Type Description

PUBCHEM

169490785

Created by admin on Wed Apr 02 17:39:56 GMT 2025 , Edited by admin on Wed Apr 02 17:39:56 GMT 2025

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FDA UNII

KSZ5XRQ7WX

Created by admin on Wed Apr 02 17:39:56 GMT 2025 , Edited by admin on Wed Apr 02 17:39:56 GMT 2025

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CAS

2724840-73-5

Created by admin on Wed Apr 02 17:39:56 GMT 2025 , Edited by admin on Wed Apr 02 17:39:56 GMT 2025

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N-Desmethyl,N-2(2-cyanobenzyl) Alogliptin, (R)-

ENANTIOMER -> ENANTIOMER

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