RO-5028442

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H28ClN3O2
Molecular Weight	437.962
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN(C)CCN1C=C(C(=O)N2CCC3(CC2)OCC4=CC=CC=C34)C5=C1C=C(Cl)C=C5

InChI

InChIKey=QZXVLRCMAHJVIP-UHFFFAOYSA-N

InChI=1S/C25H28ClN3O2/c1-27(2)13-14-29-16-21(20-8-7-19(26)15-23(20)29)24(30)28-11-9-25(10-12-28)22-6-4-3-5-18(22)17-31-25/h3-8,15-16H,9-14,17H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C25H28ClN3O2
Molecular Weight	437.962
Charge	0
Count

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

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/27711048 | https://www.ncbi.nlm.nih.gov/pubmed/25654260 | https://clinicaltrials.gov/ct2/show/NCT01474278

RO-5028442 (RG7713) is a potent and highly selective arginine vasopressin receptor 1A (V1a) antagonist. This compound has been studied for use in autistic spectrum disorder. A phase I study in adult male high-functioning autistic patients has been completed in 2016 and showed that blockade of the V1a receptor may improve social communication in adults with high-functioning ASD. Eye-tracking results showed an increase in biological motion orienting preference. Only mild or moderate adverse events were reported.

Originator

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:13:23 GMT 2025` Edited by `admin` on `Mon Mar 31 23:13:23 GMT 2025`
Record UNII	LZ0EU1YHCK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RO-5028442

Common Name

English

RO5028442

Preferred Name

English

METHANONE, (6-CHLORO-1-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-3-YL)SPIRO(ISOBENZOFURAN-1(3H),4'-PIPERIDIN)-1'-YL-

Systematic Name

English

(6-CHLORO-1-(2-(DIMETHYLAMINO)ETHYL)INDOL-3-YL)-SPIRO(1H-ISOBENZOFURAN-3,4'-PIPERIDINE)-1'-YL-METHANONE

Systematic Name

English

Code System Code Type Description

ChEMBL

CHEMBL3545342