AD 20

CAT: 0013-GTR19200598-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19200598-01Size:25 mg

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Description

AD 20 is a research compound designed to mitigate toxicity while potentiating the efficacy of anticancer agents. It is utilized in both in vitro and in vivo oncology research to study chemosensitization and reduce adverse drug effects.

CAS Number

111542-07-5

Smiles

C (C (NC (C (O) =O) =C) =O) C1=C (OC) C=CC=C1

Molecular Formula

C12H13NO4

Molecular Weight

235.24

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

AD 20

designed to reduce toxicity or enhance activity of anticancer drugs

CAS Number	111542-07-5
PubChem CID	159468
IUPAC Name	2-[[2-(2-methoxyphenyl)acetyl]amino]prop-2-enoic acid
Molecular Formula	C12H13NO4
Molecular Weight	235.24
XLogP	1.3
Topological Polar Surface Area	75.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	17
Formal Charge	0
Complexity	314

SMILES

COC1=CC=CC=C1CC(=O)NC(=C)C(=O)O

InChI

InChI=1S/C12H13NO4/c1-8(12(15)16)13-11(14)7-9-5-3-4-6-10(9)17-2/h3-6H,1,7H2,2H3,(H,13,14)(H,15,16)

InChIKey

JJLSSLSXTRMIGR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 111542-07-5

CID: 159468

Formula: C12H13NO4

MW: 235.24

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	235.24
XLogP3	1.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	235.08445790
Monoisotopic Mass	235.08445790
Topological Polar Surface Area	75.6 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	314
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

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