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LR 1143

CAT: 0013-GTR19209546-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209546-02Size:50 mg
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Description
LR 1143 is a small molecule dopamine transporter (DAT) inhibitor. It is used in neuroscience research to study dopaminergic signaling, with applications in both in vitro binding assays and in vivo models of dopamine-related neurobiology.
CAS Number
150151-15-8
Smiles
C (OCCN1CCN (CCCC2=CC=CC=C2) CCC1) (C3=CC=C (F) C=C3) C4=CC=C (F) C=C4
Molecular Formula
C29H34F2N2O
Molecular Weight
464.59
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

LR 1143

an inhibitor of dopamine transport; structure given in first source

CAS Number150151-15-8
PubChem CID10837863
IUPAC Name1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)-1,4-diazepane
Molecular FormulaC29H34F2N2O
Molecular Weight464.6
XLogP6
Topological Polar Surface Area15.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count34
Formal Charge0
Complexity520
SMILES
C1CN(CCN(C1)CCOC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CCCC4=CC=CC=C4
InChI
InChI=1S/C29H34F2N2O/c30-27-13-9-25(10-14-27)29(26-11-15-28(31)16-12-26)34-23-22-33-19-5-18-32(20-21-33)17-4-8-24-6-2-1-3-7-24/h1-3,6-7,9-16,29H,4-5,8,17-23H2
InChIKey
DUNNQMCSUALPMK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of LR 1143
CAS: 150151-15-8
CID: 10837863
Formula: C29H34F2N2O
MW: 464.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight464.6
XLogP36
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass464.26392004
Monoisotopic Mass464.26392004
Topological Polar Surface Area15.7 Ų
Heavy Atom Count34
Formal Charge0
Complexity520
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

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