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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16ClN3O
Molecular Weight 313.781
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of YM-976

SMILES

CCN1C(=O)N=C(C2=CC(Cl)=CC=C2)C3=C1N=C(CC)C=C3

InChI

InChIKey=MNHXYNNKDDXKNP-UHFFFAOYSA-N
InChI=1S/C17H16ClN3O/c1-3-13-8-9-14-15(11-6-5-7-12(18)10-11)20-17(22)21(4-2)16(14)19-13/h5-10H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C17H16ClN3O
Molecular Weight 313.781
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
2.2 nM [IC50]
PubMed

PubMed

TitleDatePubMed
A novel phosphodiesterase type 4 inhibitor, YM976 (4-(3-chlorophenyl)-1,7-diethylpyrido[2,3-d]pyrimidin-2(1H)-one), with little emetogenic activity.
2000 Oct
Relaxant effect of YM976, a novel phosphodiesterase 4 inhibitor, on bovine tracheal smooth muscle.
2003 May 30
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:06:08 UTC 2023
Edited
by admin
on Sat Dec 16 18:06:08 UTC 2023
Record UNII
7GQT2M8W42
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
YM-976
Common Name English
4-(3-CHLOROPHENYL)-1,7-DIETHYLPYRIDO(2,3-D)PYRIMIDIN-2(1H)-ONE
Systematic Name English
PYRIDO(2,3-D)PYRIMIDIN-2(1H)-ONE, 4-(3-CHLOROPHENYL)-1,7-DIETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
7GQT2M8W42
Created by admin on Sat Dec 16 18:06:08 UTC 2023 , Edited by admin on Sat Dec 16 18:06:08 UTC 2023
PRIMARY
WIKIPEDIA
YM-976
Created by admin on Sat Dec 16 18:06:08 UTC 2023 , Edited by admin on Sat Dec 16 18:06:08 UTC 2023
PRIMARY
CAS
191219-80-4
Created by admin on Sat Dec 16 18:06:08 UTC 2023 , Edited by admin on Sat Dec 16 18:06:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID70424991
Created by admin on Sat Dec 16 18:06:08 UTC 2023 , Edited by admin on Sat Dec 16 18:06:08 UTC 2023
PRIMARY
PUBCHEM
6604918
Created by admin on Sat Dec 16 18:06:08 UTC 2023 , Edited by admin on Sat Dec 16 18:06:08 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
REPRESENTATIVE PDE4
INHIBITOR
IC50
Related Record Type Details
ACTIVE MOIETY