LBW-242

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H42N4O2
Molecular Weight	454.648
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CCN(C(=O)[C@@H](NC(=O)[C@H](C)NC)C3CCCCC3)[C@]1([H])CN(CCC4=CC=CC=C4)CC2

InChI

InChIKey=HCSMRSHIIKPNAK-LSAVBLLPSA-N

InChI=1S/C27H42N4O2/c1-20(28-2)26(32)29-25(23-11-7-4-8-12-23)27(33)31-18-15-22-14-17-30(19-24(22)31)16-13-21-9-5-3-6-10-21/h3,5-6,9-10,20,22-25,28H,4,7-8,11-19H2,1-2H3,(H,29,32)/t20-,22+,24+,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H42N4O2
Molecular Weight	454.648
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:48:13 GMT 2023` Edited by `admin` on `Sat Dec 16 10:48:13 GMT 2023`
Record UNII	NG5DD6UA5D
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

LBW-242

Code

English

LBW242

Code

English

(2S)-N-((1S)-1-CYCLOHEXYL-2-((3AR,7AS)-OCTAHYDRO-6-(2-PHENYLETHYL)-1H-PYRROLO(2,3-C)PYRIDIN-1-YL)-2-OXOETHYL)-2-(METHYLAMINO)PROPANAMIDE

Systematic Name

English

LBW 242 [WHO-DD]

Common Name

English

PROPANAMIDE, N-((1S)-1-CYCLOHEXYL-2-((3AR,7AS)-OCTAHYDRO-6-(2-PHENYLETHYL)-1H-PYRROLO(2,3-C)PYRIDIN-1-YL)-2-OXOETHYL)-2-(METHYLAMINO)-, (2S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

NG5DD6UA5D

Created by admin on Sat Dec 16 10:48:13 GMT 2023 , Edited by admin on Sat Dec 16 10:48:13 GMT 2023

PRIMARY

PUBCHEM

11503417

Created by admin on Sat Dec 16 10:48:13 GMT 2023 , Edited by admin on Sat Dec 16 10:48:13 GMT 2023

PRIMARY

EPA CompTox

DTXSID701101698

Created by admin on Sat Dec 16 10:48:13 GMT 2023 , Edited by admin on Sat Dec 16 10:48:13 GMT 2023

PRIMARY

CAS

867324-12-7

Created by admin on Sat Dec 16 10:48:13 GMT 2023 , Edited by admin on Sat Dec 16 10:48:13 GMT 2023

PRIMARY

Related Record Type Details


					NG5DD6UA5D

LBW-242

ACTIVE MOIETY

Amount: