Fluoroclebopride 25mg

CAT: 0628-A14056-25Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0628-A14056-25Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

154540-49-5

Chemical Information

Fluoroclebopride

structure given in first source; a dopamine D1 and D2 receptor-based imaging agent

CAS Number	154540-49-5
PubChem CID	127887
IUPAC Name	4-amino-5-chloro-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methoxybenzamide
Molecular Formula	C20H23ClFN3O2
Molecular Weight	391.9
XLogP	3.3
Topological Polar Surface Area	67.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	27
Formal Charge	0
Complexity	482

SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=C(C=C3)F)Cl)N

InChI

InChI=1S/C20H23ClFN3O2/c1-27-19-11-18(23)17(21)10-16(19)20(26)24-15-6-8-25(9-7-15)12-13-2-4-14(22)5-3-13/h2-5,10-11,15H,6-9,12,23H2,1H3,(H,24,26)

InChIKey

HKDIGEWWDHALIS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 154540-49-5

CID: 127887

Formula: C20H23ClFN3O2

MW: 391.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	391.9
XLogP3	3.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	391.1462828
Monoisotopic Mass	391.1462828
Topological Polar Surface Area	67.6 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	482
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
A14056-500	Fluoroclebopride 500mg
A14056-50	Fluoroclebopride 50mg
A14056-100	Fluoroclebopride 100mg
A14056-10	Fluoroclebopride 10mg
A14056-5	Fluoroclebopride 5mg
A14056-1	Fluoroclebopride 1mg
A14056-10mM-D	Fluoroclebopride 10mM * 1mL in DMSO
A13047-25	A-205804 25mg
A14328-25	Sagopilone 25mg
A24249-25	LXG6403 25mg