Plerixafor (AMD3100)

CAT: 1568-C13136-01Size: 5 mgDry Ice: YesHazardous: No

1 / 1

CAT#:1568-C13136-01Size:5 mg

Selected

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

Quick Request Actions

CAS Number

110078-46-1

Synonyms

JM 3100, SID791

SKU

C13136-10mg

Target

CXCR

Applications

GPCR & G Protein

Smiles

C1CNCCNCCCN (CCNC1) CC2=CC=C (C=C2) CN3CCCNCCNCCCNCC3

Molecular Formula

C28H54N8

Additionnal Information

Plerixafor (AMD3100, JM 3100, SID791) is a chemokine receptor antagonist for CXCR4 and CXCL12-mediated chemotaxis with IC50 of 44 nM and 5.7 nM in cell-free assays, respectively. Plerixafor inhibits human immunodeficiency virus (HIV) replication.

Storage Conditions

2 years -80 in solvent

Chemical Information

Plerixafor

Plerixafor is an azamacrocycle consisting of two cyclam rings connected by a 1,4-phenylenebis(methylene) linker. It is a CXCR4 chemokine receptor antagonist and a hematopoietic stem cell mobilizer. It is used in combination with grulocyte-colony stimulating factor (G-CSF) to mobilize hematopoietic stem cells to the perpheral blood for collection and subsequent autologous transplantation in patients with non-Hodgkin's lymphoma and multiple myeloma. It has a role as a C-X-C chemokine receptor type 4 antagonist, an antineoplastic agent, an immunological adjuvant and an anti-HIV agent. It is a member of benzenes, a crown amine, an azacycloalkane, a secondary amino compound, a tertiary amino compound and an azamacrocycle. It is functionally related to a 1,4,8,11-tetraazacyclotetradecane.

CAS Number	110078-46-1
PubChem CID	65015
IUPAC Name	1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane
Molecular Formula	C28H54N8
Molecular Weight	502.8
XLogP	0
Topological Polar Surface Area	78.7
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Heavy Atom Count	36
Formal Charge	0
Complexity	456

SMILES

C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CN3CCCNCCNCCCNCC3

InChI

InChI=1S/C28H54N8/c1-9-29-15-17-31-13-3-21-35(23-19-33-11-1)25-27-5-7-28(8-6-27)26-36-22-4-14-32-18-16-30-10-2-12-34-20-24-36/h5-8,29-34H,1-4,9-26H2

InChIKey

YIQPUIGJQJDJOS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 110078-46-1

CID: 65015

Formula: C28H54N8

MW: 502.8

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	502.8
XLogP3	0
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Exact Mass	502.44714376
Monoisotopic Mass	502.44714376
Topological Polar Surface Area	78.7 Å²
Heavy Atom Count	36
Formal Charge	0
Complexity	456
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

Alternative Products

Catalog	Name
A2025-5.1	Plerixafor (AMD3100)
MBS385227-01	AMD3100 (Plerixafor)
A13074-10	AMD3100 (Plerixafor) 10mg
S3013-50mg	Plerixafor (AMD3100) 8HCl
A13074-200	AMD3100 (Plerixafor) 200mg
A13074-500	AMD3100 (Plerixafor) 500mg
A13074-100	AMD3100 (Plerixafor) 100mg
A13074-50	AMD3100 (Plerixafor) 50mg
A13074-25	AMD3100 (Plerixafor) 25mg
A13074-5	AMD3100 (Plerixafor) 5mg

Plerixafor (AMD3100)

Chemical Information

Alternative Products

Popular Products