TRILACICLIB

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H30N8O
Molecular Weight	446.5489
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TRILACICLIB

Structure Search

SMILES

CN1CCN(CC1)c2ccc(nc2)N=c3[nH]cc4cc5C(=O)NCC6(CCCCC6)n5c4n3

InChI

InChIKey=PDGKHKMBHVFCMG-UHFFFAOYSA-N

InChI=1S/C24H30N8O/c1-30-9-11-31(12-10-30)18-5-6-20(25-15-18)28-23-26-14-17-13-19-22(33)27-16-24(7-3-2-4-8-24)32(19)21(17)29-23/h5-6,13-15H,2-4,7-12,16H2,1H3,(H,27,33)(H,25,26,28,29)

HIDE SMILES / InChI

Molecular Formula	C24H30N8O
Molecular Weight	446.5489
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Jun 26 06:02:42 UTC 2021` Edited by `admin` on `Sat Jun 26 06:02:42 UTC 2021`
Record UNII	U6072DO9XG
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

TRILACICLIB

Official Name

English

G1T28

Code

English

2'-((5-(4-METHYLPIPERAZIN-1-YL)PYRIDIN-2-YL)AMINO)-7',8'-DIHYDRO-6'HSPIRO(CYCLOHEXANE-1,9'-PYRAZINO(1',2':1,5)PYRROLO(2,3-D)PYRIMIDIN)-6'-ONE

Systematic Name

English

SPIRO(CYCLOHEXANE-1,9'(6'H)-PYRAZINO(1',2':1,5)PYRROLO(2,3-D)PYRIMIDIN)-6'-ONE, 7',8'-DIHYDRO-2'-((5-(4-METHYL-1-PIPERAZINYL)-2-PYRIDINYL)AMINO)-

Systematic Name

English

TRILACICLIB [USAN]

Common Name

English

TRILACICLIB [INN]

Common Name

English

TRILACICLIB [WHO-DD]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C129825

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

NCI_THESAURUS

C2185

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

Code System Code Type Description

ChEMBL

CHEMBL3544940

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

PRIMARY

NCI_THESAURUS

C123281

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

PRIMARY

DRUG BANK

DB15442

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

PRIMARY

FDA UNII

U6072DO9XG

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

PRIMARY

INN

10565

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

PRIMARY

CAS

1374743-00-6

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

PRIMARY

PUBCHEM

68029831

Created by admin on Sat Jun 26 06:02:42 UTC 2021 , Edited by admin on Sat Jun 26 06:02:42 UTC 2021

PRIMARY

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SALT/SOLVATE -> PARENT


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Qualification:

FECAL

Amount:


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					U6072DO9XG

EXCRETED UNCHANGED

Amount:

Related Record Type Details


					U6072DO9XG

ACTIVE MOIETY

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
Biological Half-life	PHARMACOKINETIC		`U6072DO9XG` TRILACICLIB

Volume of Distribution	PHARMACOKINETIC		`U6072DO9XG` TRILACICLIB

blood/plasma ratio	PHARMACOKINETIC		`U6072DO9XG` TRILACICLIB