Products for Research Use Only
RegisterLogin

Plerixafor Impurity I

CAT: 1299-RM-P122409-02Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1299-RM-P122409-02Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
128495-29-4
Synonyms
1-tosyl-1,4,8,11-tetraazacyclotetradecane
Molecular Formula
C17H30N4O2S
Molecular Weight
354.51
Target Alternative Name
Plerixafor
Product Name Synonym
1-tosyl-1,4,8,11-tetraazacyclotetradecane

Chemical Information

1-Tosyl-1,4,8,11-Tetraazacyclotetradecane
CAS Number128495-29-4
PubChem CID11405552
IUPAC Name1-(4-methylphenyl)sulfonyl-1,4,8,11-tetrazacyclotetradecane
Molecular FormulaC17H30N4O2S
Molecular Weight354.5
XLogP0.6
Topological Polar Surface Area81.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity430
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N2CCCNCCNCCCNCC2
InChI
InChI=1S/C17H30N4O2S/c1-16-4-6-17(7-5-16)24(22,23)21-14-3-10-19-12-11-18-8-2-9-20-13-15-21/h4-7,18-20H,2-3,8-15H2,1H3
InChIKey
CHQVBJOMKHIJLJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Tosyl-1,4,8,11-Tetraazacyclotetradecane
CAS: 128495-29-4
CID: 11405552
Formula: C17H30N4O2S
MW: 354.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.5
XLogP30.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass354.20894739
Monoisotopic Mass354.20894739
Topological Polar Surface Area81.9 Ų
Heavy Atom Count24
Formal Charge0
Complexity430
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

Related Products

CatalogName
RM-P122401-01Plerixafor Impurity A
RM-P122464-01Plerixafor Impurity 35
RM-P122463-01Plerixafor Impurity 34
RM-P122433-01Plerixafor Impurity 7
RM-P122434-01Plerixafor Impurity 8
RM-P122454-01Plerixafor Impurity 25
RM-P122450-01Plerixafor Impurity 21
RM-P122455-01Plerixafor Impurity 26
RM-P122438-01Plerixafor Impurity 12
RM-P122462-01Plerixafor Impurity 33

Alternative Products

CatalogName
AR-P31997-01Plerixafor Impurity 15
AR-P32009-01Plerixafor Impurity 32
AR-P32019-01Plerixafor Impurity 43
AR-P32025-01Plerixafor Impurity 45
AR-P31995-01Plerixafor Methyl Impurity
AR-P32013-01Plerixafor Impurity 36
AR-P29834-01Plerixafor Monocyclam Impurity
AR-P32011-01Plerixafor Impurity 34
AR-P32018-01Plerixafor Impurity 38
AR-P32006-01Plerixafor Impurity 25

Popular Products