PEXOPIPRANT L-LYSINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H17Cl2F2NO4.C6H14N2O2
Molecular Weight	602.454
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NCCCC[C@H](N)C(O)=O.CCC1=NC2=C(Cl)C=CC(OCC(O)=O)=C2C(OC(F)F)=C1CC3=CC=C(Cl)C=C3

InChI

InChIKey=OBWLGPAIWBISLU-ZSCHJXSPSA-N

InChI=1S/C21H17Cl2F2NO4.C6H14N2O2/c1-2-15-13(9-11-3-5-12(22)6-4-11)20(30-21(24)25)18-16(29-10-17(27)28)8-7-14(23)19(18)26-15;7-4-2-1-3-5(8)6(9)10/h3-8,21H,2,9-10H2,1H3,(H,27,28);5H,1-4,7-8H2,(H,9,10)/t;5-/m.0/s1

HIDE SMILES / InChI

Molecular Formula	C21H17Cl2F2NO4
Molecular Weight	456.267
Charge	0
Count

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

Molecular Formula	C6H14N2O2
Molecular Weight	146.1876
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:09:10 UTC 2023` Edited by `admin` on `Fri Dec 15 18:09:10 UTC 2023`
Record UNII	2J22P06SNZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PEXOPIPRANT L-LYSINE

Common Name

English

Code System Code Type Description

FDA UNII

2J22P06SNZ

Created by admin on Fri Dec 15 18:09:10 UTC 2023 , Edited by admin on Fri Dec 15 18:09:10 UTC 2023

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PUBCHEM

132143319

Created by admin on Fri Dec 15 18:09:10 UTC 2023 , Edited by admin on Fri Dec 15 18:09:10 UTC 2023

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SMS_ID

300000017332

Created by admin on Fri Dec 15 18:09:10 UTC 2023 , Edited by admin on Fri Dec 15 18:09:10 UTC 2023

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CAS

2155800-40-9

Created by admin on Fri Dec 15 18:09:10 UTC 2023 , Edited by admin on Fri Dec 15 18:09:10 UTC 2023

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