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YF479

CAT: 0013-GTR19200057-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19200057-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
YF479 is a histone deacetylase (HDAC) inhibitor developed for research use. It has demonstrated efficacy in suppressing tumor growth and metastasis in breast cancer models, showing potential for studies on recurrence in both in vitro and in vivo experimental settings.
CAS Number
1803281-22-2
Field of Research
Epigenetics & Chromatin, Molecular Biology
Smiles
N (CC1=CC (Br) =CC=C1) (C (CCCCCC (NO) =O) =O) C2=C (OC) C=C (OC) C=C2
Molecular Formula
C22H27BrN2O5
Molecular Weight
479.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N'-[(3-bromophenyl)methyl]-N'-(2,4-dimethoxyphenyl)-N-hydroxyheptanediamide
CAS Number1803281-22-2
PubChem CID71616871
IUPAC NameN'-[(3-bromophenyl)methyl]-N'-(2,4-dimethoxyphenyl)-N-hydroxyheptanediamide
Molecular FormulaC22H27BrN2O5
Molecular Weight479.4
XLogP3.4
Topological Polar Surface Area88.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count30
Formal Charge0
Complexity536
SMILES
COC1=CC(=C(C=C1)N(CC2=CC(=CC=C2)Br)C(=O)CCCCCC(=O)NO)OC
InChI
InChI=1S/C22H27BrN2O5/c1-29-18-11-12-19(20(14-18)30-2)25(15-16-7-6-8-17(23)13-16)22(27)10-5-3-4-9-21(26)24-28/h6-8,11-14,28H,3-5,9-10,15H2,1-2H3,(H,24,26)
InChIKey
SZNMMWLGOPSQBV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N'-[(3-bromophenyl)methyl]-N'-(2,4-dimethoxyphenyl)-N-hydroxyheptanediamide
CAS: 1803281-22-2
CID: 71616871
Formula: C22H27BrN2O5
MW: 479.4
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight479.4
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass478.11033
Monoisotopic Mass478.11033
Topological Polar Surface Area88.1 Ų
Heavy Atom Count30
Formal Charge0
Complexity536
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
MBS5774694YF479

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