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Details

Stereochemistry ACHIRAL
Molecular Formula C17H21N5
Molecular Weight 295.3821
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of A-940894

SMILES

NC1=NC(N2CCNCC2)=C3CCCC4=CC=CC=C4C3=N1

InChI

InChIKey=KUZRWWLVBUPCRK-UHFFFAOYSA-N
InChI=1S/C17H21N5/c18-17-20-15-13-6-2-1-4-12(13)5-3-7-14(15)16(21-17)22-10-8-19-9-11-22/h1-2,4,6,19H,3,5,7-11H2,(H2,18,20,21)

HIDE SMILES / InChI

Molecular Formula C17H21N5
Molecular Weight 295.3821
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
In vitro and in vivo characterization of A-940894: a potent histamine H4 receptor antagonist with anti-inflammatory properties.
2009-05
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 23:32:20 GMT 2025
Edited
by admin
on Mon Mar 31 23:32:20 GMT 2025
Record UNII
8U5620H545
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
A-940894
Common Name English
(4-(PIPERAZIN-1-YL)-6,7-DIHYDRO-5H-BENZO(6,7)CYCLOHEPTA(1,2-D)PYRIMIDIN-2-YL)AMINE
Preferred Name English
5H-BENZO(6,7)CYCLOHEPTA(1,2-D)PYRIMIDIN-2-AMINE, 6,7-DIHYDRO-4-(1-PIPERAZINYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
8U5620H545
Created by admin on Mon Mar 31 23:32:20 GMT 2025 , Edited by admin on Mon Mar 31 23:32:20 GMT 2025
PRIMARY
CAS
1027330-82-0
Created by admin on Mon Mar 31 23:32:20 GMT 2025 , Edited by admin on Mon Mar 31 23:32:20 GMT 2025
PRIMARY
PUBCHEM
25071319
Created by admin on Mon Mar 31 23:32:20 GMT 2025 , Edited by admin on Mon Mar 31 23:32:20 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY