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Oxatomide

CAT: 0607-BA5008-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA5008-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
60607-34-3
Form
A solid
Molecular Formula
C27H30N4O
Molecular Weight
426.55
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Oxatomide

Oxatomide is a member of the class of benzimidazoles that is 1,3-dihydro-2H-benzimidazol-2-one substituted by a 3-[4-(diphenylmethyl)piperazin-1-yl]propyl group at position 1. It is an anti-allergic drug. It has a role as a geroprotector, a H1-receptor antagonist, a serotonergic antagonist, an anti-allergic agent and an anti-inflammatory agent. It is a member of benzimidazoles, a N-alkylpiperazine and a diarylmethane.

CAS Number60607-34-3
PubChem CID4615
IUPAC Name3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-1H-benzimidazol-2-one
Molecular FormulaC27H30N4O
Molecular Weight426.6
XLogP4.1
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity574
SMILES
C1CN(CCN1CCCN2C3=CC=CC=C3NC2=O)C(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C27H30N4O/c32-27-28-24-14-7-8-15-25(24)31(27)17-9-16-29-18-20-30(21-19-29)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,26H,9,16-21H2,(H,28,32)
InChIKey
BAINIUMDFURPJM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Oxatomide
CAS: 60607-34-3
CID: 4615
Formula: C27H30N4O
MW: 426.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight426.6
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass426.24196159
Monoisotopic Mass426.24196159
Topological Polar Surface Area38.8 Ų
Heavy Atom Count32
Formal Charge0
Complexity574
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

CatalogName
286081-01Oxatomide
HY-123205R-01Oxatomide (Standard)
GTR19231950-01Oxatomide-HCl
CS-O-63535N-Nitroso oxatomide
CS-O-63536N-Nitroso oxatomide Impurity 1
MBS6062767-01Oxatomide (1-[3-[4-(Diphenylmethyl)-1-piperazinyl]propyl]-1,3-dihydro-2H-benzimidazol-2-one,R-35443, Celtect, Cobiona, Dasten, Tinset)
O8107Oxatomide (1-[3-[4- (Diphenylmethyl) -1-piperazinyl]propyl]-1,3-dihydro-2H-benzimidazol-2-one, _x000B_R-35443, Celtect, Cobiona, Dasten, Tinset)

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