1-(2,4-BIS(TRIFLUOROMETHYL)-6,8-DIHYDRO-5H-PYRIDO(3,4-D)PYRIMIDIN-7-YL)-2-((2S)-6,6-DIFLUORO-3,5,7,8-TETRAHYDRO-2H-IMIDAZO(1,2-A)PYRIDIN-2-YL)ETHANONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H17F8N5O
Molecular Weight	471.3477
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(2,4-BIS(TRIFLUOROMETHYL)-6,8-DIHYDRO-5H-PYRIDO(3,4-D)PYRIMIDIN-7-YL)-2-((2S)-6,6-DIFLUORO-3,5,7,8-TETRAHYDRO-2H-IMIDAZO(1,2-A)PYRIDIN-2-YL)ETHANONE

Structure Search

SMILES

[H][C@]3(CC(=O)N1CCC2=C(N=C(N=C2C1)C(F)(F)F)C(F)(F)F)CN4CC(F)(F)CCC4=N3

InChI

InChIKey=MREUJPKTSUSJBT-VIFPVBQESA-N

InChI=1S/C18H17F8N5O/c19-16(20)3-1-12-27-9(6-31(12)8-16)5-13(32)30-4-2-10-11(7-30)28-15(18(24,25)26)29-14(10)17(21,22)23/h9H,1-8H2/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H17F8N5O
Molecular Weight	471.3477
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 `Thu Jul 06 22:01:31 UTC 2023` Edited by `admin` on `Thu Jul 06 22:01:31 UTC 2023`
Record UNII	S92B53XL26
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1-(2,4-BIS(TRIFLUOROMETHYL)-6,8-DIHYDRO-5H-PYRIDO(3,4-D)PYRIMIDIN-7-YL)-2-((2S)-6,6-DIFLUORO-3,5,7,8-TETRAHYDRO-2H-IMIDAZO(1,2-A)PYRIDIN-2-YL)ETHANONE

Systematic Name

English

LC15-0516

Common Name

English

Code System Code Type Description

PUBCHEM

151116195

Created by admin on Thu Jul 06 22:01:31 UTC 2023 , Edited by admin on Thu Jul 06 22:01:31 UTC 2023

PRIMARY

FDA UNII

S92B53XL26

Created by admin on Thu Jul 06 22:01:31 UTC 2023 , Edited by admin on Thu Jul 06 22:01:31 UTC 2023

PRIMARY

Related Record Type Details


					5DHU18M5D6

GEMIGLIPTIN

PARENT -> METABOLITE

Qualification:

URINE

Amount:


					5DHU18M5D6

GEMIGLIPTIN

PARENT -> METABOLITE

Qualification:

FECAL

Amount: