BWA-78U HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H12FN5.ClH
Molecular Weight	293.727
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CNC1=NC=NC2=C1N=CN2CC3=C(F)C=CC=C3

InChI

InChIKey=ONJKJJFUXUTARC-UHFFFAOYSA-N

InChI=1S/C13H12FN5.ClH/c1-15-12-11-13(17-7-16-12)19(8-18-11)6-9-4-2-3-5-10(9)14;/h2-5,7-8H,6H2,1H3,(H,15,16,17);1H

HIDE SMILES / InChI

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

Molecular Formula	C13H12FN5
Molecular Weight	257.2663
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 `Fri Dec 15 15:03:29 GMT 2023` Edited by `admin` on `Fri Dec 15 15:03:29 GMT 2023`
Record UNII	9TAW9YW2N0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BWA-78U HYDROCHLORIDE

Code

English

BW-A 78U HYDROCHLORIDE

Code

English

9-((2-FLUOROPHENYL)METHYL)-N-METHYL-9H-PURIN-6-AMINE

Systematic Name

English

9H-PURIN-6-AMINE, 9-((2-FLUOROPHENYL)METHYL)-N-METHYL-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

9TAW9YW2N0

Created by admin on Fri Dec 15 15:03:29 GMT 2023 , Edited by admin on Fri Dec 15 15:03:29 GMT 2023

PRIMARY

PUBCHEM

3063591

Created by admin on Fri Dec 15 15:03:29 GMT 2023 , Edited by admin on Fri Dec 15 15:03:29 GMT 2023

PRIMARY

EPA CompTox

DTXSID20143766

Created by admin on Fri Dec 15 15:03:29 GMT 2023 , Edited by admin on Fri Dec 15 15:03:29 GMT 2023

PRIMARY

CAS

101190-60-7

Created by admin on Fri Dec 15 15:03:29 GMT 2023 , Edited by admin on Fri Dec 15 15:03:29 GMT 2023

PRIMARY

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