PNU-101017

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H27ClN4O3
Molecular Weight	442.938
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H]1CN(C[C@@H](C)N1)C(=O)C2=CC3=C(N=CN3C4=C2C=C(Cl)C=C4)C(=O)OC(C)(C)C

InChI

InChIKey=JOJRKTAQXYPHBT-OKILXGFUSA-N

InChI=1S/C23H27ClN4O3/c1-13-10-27(11-14(2)26-13)21(29)17-9-19-20(22(30)31-23(3,4)5)25-12-28(19)18-7-6-15(24)8-16(17)18/h6-9,12-14,26H,10-11H2,1-5H3/t13-,14+

HIDE SMILES / InChI

Molecular Formula	C23H27ClN4O3
Molecular Weight	442.938
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 21:47:55 GMT 2025` Edited by `admin` on `Tue Apr 01 21:47:55 GMT 2025`
Record UNII	WOT9966OPK
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PNU-101017

Code

English

U-101017

Preferred Name

English

IMIDAZO(1,5-A)QUINOLINE-3-CARBOXYLIC ACID, 7-CHLORO-5-((3,5-DIMETHYL-1-PIPERAZINYL)CARBONYL)-, 1,1-DIMETHYLETHYL ESTER, CIS-

Systematic Name

English

IMIDAZO(1,5-A)QUINOLINE-3-CARBOXYLIC ACID, 7-CHLORO-5-(((3R,5S)-3,5-DIMETHYL-1-PIPERAZINYL)CARBONYL)-, 1,1-DIMETHYLETHYL ESTER, REL-

Systematic Name

English

Code System Code Type Description

CAS

170568-47-5

Created by admin on Tue Apr 01 21:47:55 GMT 2025 , Edited by admin on Tue Apr 01 21:47:55 GMT 2025

PRIMARY

FDA UNII

WOT9966OPK

Created by admin on Tue Apr 01 21:47:55 GMT 2025 , Edited by admin on Tue Apr 01 21:47:55 GMT 2025

PRIMARY

PUBCHEM

9868017

Created by admin on Tue Apr 01 21:47:55 GMT 2025 , Edited by admin on Tue Apr 01 21:47:55 GMT 2025

PRIMARY

Related Record Type Details


					Y64I47S8UV

PNU-101017 MALONATE

SALT/SOLVATE -> PARENT