MB710

CAT: 1410-M13571-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No

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CAT#:1410-M13571-02Size:1 mL x 10 mM in DMSO

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

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Description

MB710 is a small-molecule p53 mutant Y220C stabilizer, binds tightly to the Y220C pocket and stabilizes p53-Y220C in vitro.

CAS Number

2230044-57-0

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

457.286

Molecular Formula

C16H16IN3O3S

Notes

Research use only, not for human use.

Receptor

MDM2-p53

Chemical Information

2-(Diethylamino)-6-iodanyl-5-oxidanyl-7-pyrrol-1-yl-1,3-benzothiazole-4-carboxylic acid

CAS Number	2230044-57-0
PubChem CID	133082032
IUPAC Name	2-(diethylamino)-5-hydroxy-6-iodo-7-pyrrol-1-yl-1,3-benzothiazole-4-carboxylic acid
Molecular Formula	C16H16IN3O3S
Molecular Weight	457.3
XLogP	4.3
Topological Polar Surface Area	107
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Heavy Atom Count	24
Formal Charge	0
Complexity	462

SMILES

CCN(CC)C1=NC2=C(C(=C(C(=C2S1)N3C=CC=C3)I)O)C(=O)O

InChI

InChI=1S/C16H16IN3O3S/c1-3-19(4-2)16-18-11-9(15(22)23)13(21)10(17)12(14(11)24-16)20-7-5-6-8-20/h5-8,21H,3-4H2,1-2H3,(H,22,23)

InChIKey

SEBJATZOIHUGAU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2230044-57-0

CID: 133082032

Formula: C16H16IN3O3S

MW: 457.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	457.3
XLogP3	4.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Exact Mass	456.99571
Monoisotopic Mass	456.99571
Topological Polar Surface Area	107 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	462
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

Catalog	Name
564327	MB710