ASP-4058 HYDROCHLORIDE

Investigational

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H12F6N4O2.ClH
Molecular Weight	478.776
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.C[C@H](OC1=CC=C(C=C1C(F)(F)F)C2=NC(=NO2)C3=CC=C4NC=NC4=C3)C(F)(F)F

InChI

InChIKey=KRUYZACYZSOZCV-FVGYRXGTSA-N

InChI=1S/C19H12F6N4O2.ClH/c1-9(18(20,21)22)30-15-5-3-11(6-12(15)19(23,24)25)17-28-16(29-31-17)10-2-4-13-14(7-10)27-8-26-13;/h2-9H,1H3,(H,26,27);1H/t9-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C19H12F6N4O2
Molecular Weight	442.3146
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 08:35:55 GMT 2023` Edited by `admin` on `Sat Dec 16 08:35:55 GMT 2023`
Record UNII	9Q305243EU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ASP-4058 HYDROCHLORIDE

Common Name

English

ASP4058 HYDROCHLORIDE

Code

English

5-(5-(3-(TRIFLUOROMETHYL)-4-(((2S)-1,1,1-TRIFLUOROPROPAN-2-YL)OXY)PHENYL)-1,2,4-OXADIAZOL-3-YL)-1H-BENZIMIDAZOLE HYDROCHLORIDE

Systematic Name

English

1H-BENZIMIDAZOLE, 6-(5-(3-(TRIFLUOROMETHYL)-4-((1S)-2,2,2-TRIFLUORO-1-METHYLETHOXY)PHENYL)-1,2,4-OXADIAZOL-3-YL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

16755142

Created by admin on Sat Dec 16 08:35:55 GMT 2023 , Edited by admin on Sat Dec 16 08:35:55 GMT 2023

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CAS

952510-14-4

Created by admin on Sat Dec 16 08:35:55 GMT 2023 , Edited by admin on Sat Dec 16 08:35:55 GMT 2023

PRIMARY

FDA UNII

9Q305243EU

Created by admin on Sat Dec 16 08:35:55 GMT 2023 , Edited by admin on Sat Dec 16 08:35:55 GMT 2023

PRIMARY

DRUG BANK

DBSALT002085

Created by admin on Sat Dec 16 08:35:55 GMT 2023 , Edited by admin on Sat Dec 16 08:35:55 GMT 2023

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