TAK-070 FREE BASE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H31NO
Molecular Weight	385.5411
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN(C)CC[C@@H]1CCC2=CC(OCC3=CC=C(C=C3)C4=CC=CC=C4)=CC=C2C1

InChI

InChIKey=SETMAZMOXYOEJA-NRFANRHFSA-N

InChI=1S/C27H31NO/c1-28(2)17-16-21-8-13-26-19-27(15-14-25(26)18-21)29-20-22-9-11-24(12-10-22)23-6-4-3-5-7-23/h3-7,9-12,14-15,19,21H,8,13,16-18,20H2,1-2H3/t21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H31NO
Molecular Weight	385.5411
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
A noncompetitive BACE1 inhibitor TAK-070 ameliorates Abeta pathology and behavioral deficits in a mouse model of Alzheimer's disease.	2010 Aug 18	20720123

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:04:07 GMT 2023` Edited by `admin` on `Sat Dec 16 08:04:07 GMT 2023`
Record UNII	PNM9E64544
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

TAK-070 FREE BASE

Common Name

English

J3.229.705F

Code

English

2-((2R)-6-(4-BIPHENYLYLMETHOXY)-1,2,3,4-TETRAHYDRO-2-NAPHTHALENYL)-N,N-DIMETHYLETHANAMINE

Systematic Name

English

(2R)-N,N-DIMETHYL-6-(4-BIPHENYLYLMETHOXY)-1,2,3,4-TETRAHYDRONAPHTHALENE-2.ALPHA.-ETHANAMINE

Systematic Name

English

2-NAPHTHALENEETHANAMINE, 6-((1,1'-BIPHENYL)-4-YLMETHOXY)-1,2,3,4-TETRAHYDRO-N,N-DIMETHYL-, (2R)-

Systematic Name

English

N,N-DIMETHYL-2-((2R)-6-((4-PHENYLPHENYL)METHOXY)-1,2,3,4-TETRAHYDRONAPHTHALEN-2-YL)ETHANAMINE

Systematic Name

English

Code System Code Type Description

PUBCHEM

10112962

Created by admin on Sat Dec 16 08:04:07 GMT 2023 , Edited by admin on Sat Dec 16 08:04:07 GMT 2023

PRIMARY

FDA UNII

PNM9E64544

Created by admin on Sat Dec 16 08:04:07 GMT 2023 , Edited by admin on Sat Dec 16 08:04:07 GMT 2023

PRIMARY

CAS

212571-56-7

Created by admin on Sat Dec 16 08:04:07 GMT 2023 , Edited by admin on Sat Dec 16 08:04:07 GMT 2023

PRIMARY

Related Record Type Details


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TAK-070

SALT/SOLVATE -> PARENT