FACINICLINE HYDROCHLORIDE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H18N4O.ClH
Molecular Weight	306.791
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of FACINICLINE HYDROCHLORIDE

Structure Search

SMILES

Cl.O=C(N[C@@H]1CN2CCC1CC2)C3=NNC4=C3C=CC=C4

InChI

InChIKey=CMRLNEYJEPELSM-BTQNPOSSSA-N

InChI=1S/C15H18N4O.ClH/c20-15(14-11-3-1-2-4-12(11)17-18-14)16-13-9-19-7-5-10(13)6-8-19;/h1-4,10,13H,5-9H2,(H,16,20)(H,17,18);1H/t13-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C15H18N4O
Molecular Weight	270.3296
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

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:09:40 UTC 2023` Edited by `admin` on `Sat Dec 16 11:09:40 UTC 2023`
Record UNII	O6J463N18M
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FACINICLINE HYDROCHLORIDE

Common Name

English

N-((3S)-1-AZABICYCLO(2.2.2)OCT-3-YL)-1H-INDAZOLE-3-CARBOXAMIDE HYDROCHLORIDE

Systematic Name

English

RG-3487

Code

English

MEM 3454

Code

English

1H-INDAZOLE-3-CARBOXAMIDE, N-(3S)-1-AZABICYCLO(2.2.2)OCT-3-YL-, MONOHYDROCHLORIDE

Systematic Name

English

RG3487

Code

English

1H-INDAZOLE-3-CARBOXAMIDE, N-(3S)-1-AZABICYCLO(2.2.2)OCT-3-YL-, HYDROCHLORIDE (1:1)

Systematic Name

English

MEM-3454

Code

English

Code System Code Type Description

CAS

677305-02-1

Created by admin on Sat Dec 16 11:09:40 UTC 2023 , Edited by admin on Sat Dec 16 11:09:40 UTC 2023

PRIMARY

CAS

909910-22-1

Created by admin on Sat Dec 16 11:09:40 UTC 2023 , Edited by admin on Sat Dec 16 11:09:40 UTC 2023

NO STRUCTURE GIVEN

ChEMBL

CHEMBL3544952

Created by admin on Sat Dec 16 11:09:40 UTC 2023 , Edited by admin on Sat Dec 16 11:09:40 UTC 2023

PRIMARY

DRUG BANK

DBSALT002602

Created by admin on Sat Dec 16 11:09:40 UTC 2023 , Edited by admin on Sat Dec 16 11:09:40 UTC 2023

PRIMARY

FDA UNII

O6J463N18M

Created by admin on Sat Dec 16 11:09:40 UTC 2023 , Edited by admin on Sat Dec 16 11:09:40 UTC 2023

PRIMARY

PUBCHEM

10380472

Created by admin on Sat Dec 16 11:09:40 UTC 2023 , Edited by admin on Sat Dec 16 11:09:40 UTC 2023

PRIMARY

Related Record Type Details


					6A6FX0J03K

PARENT -> SALT/SOLVATE


					P4J1I8C6CX

NEURONAL ACETYLCHOLINE RECEPTOR SUBUNIT ALPHA-7

TARGET -> AGONIST

Comments:

(.ALPHA.7 NACHR) IN VITRO DATA KI = 6 NM (R)

Amount:

Related Record Type Details


					6A6FX0J03K

ACTIVE MOIETY