Products for Research Use Only

PD 118440

CAT: 0013-GTR19196810-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19196810-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
PD 118440 is an orally bioavailable dopamine agonist with significant central nervous system activity. It is utilized in neuroscience research to study dopaminergic pathways, employing both in vitro receptor binding assays and in vivo models of dopamine-related behaviors.
CAS Number
108351-90-2
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
C (CC) N1CC (=CCC1) C2=CSC (N) =N2
Molecular Formula
C11H17N3S
Molecular Weight
223.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

PD 118440

RN & structure given in first source; dopamine antagonist

CAS Number108351-90-2
PubChem CID194775
IUPAC Name4-(1-propyl-3,6-dihydro-2H-pyridin-5-yl)-1,3-thiazol-2-amine
Molecular FormulaC11H17N3S
Molecular Weight223.34
XLogP1.7
Topological Polar Surface Area70.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity242
SMILES
CCCN1CCC=C(C1)C2=CSC(=N2)N
InChI
InChI=1S/C11H17N3S/c1-2-5-14-6-3-4-9(7-14)10-8-15-11(12)13-10/h4,8H,2-3,5-7H2,1H3,(H2,12,13)
InChIKey
VJPANQWIZQHGMJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PD 118440
CAS: 108351-90-2
CID: 194775
Formula: C11H17N3S
MW: 223.34
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight223.34
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass223.11431873
Monoisotopic Mass223.11431873
Topological Polar Surface Area70.4 Ų
Heavy Atom Count15
Formal Charge0
Complexity242
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products