XL-388 HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H22FN3O4S.ClH
Molecular Weight	491.963
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CC1=C(C=CC(=C1F)S(C)(=O)=O)C(=O)N2CCOC3=C(C2)C=C(C=C3)C4=CC=C(N)N=C4

InChI

InChIKey=XUGXNTJUYGTLLW-UHFFFAOYSA-N

InChI=1S/C23H22FN3O4S.ClH/c1-14-18(5-7-20(22(14)24)32(2,29)30)23(28)27-9-10-31-19-6-3-15(11-17(19)13-27)16-4-8-21(25)26-12-16;/h3-8,11-12H,9-10,13H2,1-2H3,(H2,25,26);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	C23H22FN3O4S
Molecular Weight	455.502
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 09:17:40 UTC 2023` Edited by `admin` on `Sat Dec 16 09:17:40 UTC 2023`
Record UNII	I36BZ5F3D1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

XL-388 HYDROCHLORIDE

Code

English

(7-(6-AMINOPYRIDIN-3-YL)-2,3-DIHYDROBENZOL(F)(1,4)OXAZEPIN-4(5H-YL)(3FLUORO-2-METHYL-4-(METHYLSULFONYL)PHENYL)METHANONE HYDROCHLORIDE

Systematic Name

English

METHANONE, (7-(6-AMINO-3-PYRIDINYL)-2,3-DIHYDRO-1,4-BENZOXAZEPIN-4(5H)-YL)(3-FLUORO-2-METHYL-4-(METHYLSULFONYL)PHENYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

CAS

1777807-51-8

Created by admin on Sat Dec 16 09:17:40 UTC 2023 , Edited by admin on Sat Dec 16 09:17:40 UTC 2023

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FDA UNII

I36BZ5F3D1

Created by admin on Sat Dec 16 09:17:40 UTC 2023 , Edited by admin on Sat Dec 16 09:17:40 UTC 2023

PRIMARY

PUBCHEM

131634503

Created by admin on Sat Dec 16 09:17:40 UTC 2023 , Edited by admin on Sat Dec 16 09:17:40 UTC 2023

PRIMARY

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XL-388

ACTIVE MOIETY