Products for Research Use Only

AB-182

CAT: 0013-GTR19198348Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198348Size:25 mg
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Description
AB-182 is a small molecule aziridine compound exhibiting antitumor properties. It is utilized in cancer research for investigating cytotoxic mechanisms, with studies demonstrating its activity in both cell-based assays and animal models of tumor growth.
CAS Number
54805-58-2
Field of Research
Cell Biology, Molecular Biology
Smiles
P (ONC (OCC) =O) (=O) (N1C (C) (C) C1) N2C (C) (C) C2
Molecular Formula
C11H22N3O4P
Molecular Weight
291.28
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

AB-182

structure given in first source

CAS Number54805-58-2
PubChem CID41190
IUPAC Nameethyl N-bis(2,2-dimethylaziridin-1-yl)phosphoryloxycarbamate
Molecular FormulaC11H22N3O4P
Molecular Weight291.28
XLogP1
Topological Polar Surface Area70.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count19
Formal Charge0
Complexity412
SMILES
CCOC(=O)NOP(=O)(N1CC1(C)C)N2CC2(C)C
InChI
InChI=1S/C11H22N3O4P/c1-6-17-9(15)12-18-19(16,13-7-10(13,2)3)14-8-11(14,4)5/h6-8H2,1-5H3,(H,12,15)
InChIKey
AFKSFHAZSHQZMC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AB-182
CAS: 54805-58-2
CID: 41190
Formula: C11H22N3O4P
MW: 291.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight291.28
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass291.13479319
Monoisotopic Mass291.13479319
Topological Polar Surface Area70.7 Ų
Heavy Atom Count19
Formal Charge0
Complexity412
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