PBT-434 MESYLATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H13Cl2N3O2.CH4O3S
Molecular Weight	398.262
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(O)(=O)=O.CCNCC1=NC2=C(C(=O)N1C)C(Cl)=CC(Cl)=C2O

InChI

InChIKey=UBTJWJNTOFSHON-UHFFFAOYSA-N

InChI=1S/C12H13Cl2N3O2.CH4O3S/c1-3-15-5-8-16-10-9(12(19)17(8)2)6(13)4-7(14)11(10)18;1-5(2,3)4/h4,15,18H,3,5H2,1-2H3;1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula	C12H13Cl2N3O2
Molecular Weight	302.157
Charge	0
Count

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

Molecular Formula	CH4O3S
Molecular Weight	96.106
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 14:37:15 GMT 2023` Edited by `admin` on `Sat Dec 16 14:37:15 GMT 2023`
Record UNII	826P1VAG3U
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PBT-434 MESYLATE

Code

English

5,7-DICHLORO-2-((ETHYLAMINO)METHYL)-8-HYDROXY-3-METHYLQUINAZOLIN-4(3H)-ONE MESYLATE

Systematic Name

English

PBT434 MESYLATE

Code

English

Classification Tree Code System Code

FDA ORPHAN DRUG

669118

Created by admin on Sat Dec 16 14:37:15 GMT 2023 , Edited by admin on Sat Dec 16 14:37:15 GMT 2023

Code System Code Type Description

PUBCHEM

139593496

Created by admin on Sat Dec 16 14:37:15 GMT 2023 , Edited by admin on Sat Dec 16 14:37:15 GMT 2023

PRIMARY

SMS_ID

100000184233

Created by admin on Sat Dec 16 14:37:15 GMT 2023 , Edited by admin on Sat Dec 16 14:37:15 GMT 2023

PRIMARY

FDA UNII

826P1VAG3U

Created by admin on Sat Dec 16 14:37:15 GMT 2023 , Edited by admin on Sat Dec 16 14:37:15 GMT 2023

PRIMARY

Related Record Type Details


					UK4JEM5WVX

PBT-434

PARENT -> SALT/SOLVATE

Related Record Type Details


					UK4JEM5WVX

PBT-434

ACTIVE MOIETY