A-485

CAT: 1568-C13631-06Size: 1 gDry Ice: NoHazardous: No

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CAT#:1568-C13631-06Size:1 g

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

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CAS Number

1889279-16-6

SKU

C13631-2mg

Target

Histone Acetyltransferase

Applications

Epigenetics

Smiles

CC (C (F) (F) F) N (CC1=CC=C (C=C1) F) C (=O) CN2C (=O) C3 (CCC4=C3C=CC (=C4) NC (=O) NC) OC2=O

Molecular Formula

C25H24F4N4O5

Additionnal Information

A-485 is a potent, selective and drug-like p300/CBP catalytic inhibitor with an IC50 of 0.06 μM for p300 HAT. It is selective over BET bromodomain proteins and >150 non-epigenetic targets.

Storage Conditions

3 years -20°C powder

Chemical Information

A-485

A-485 is a potent and selective catalytic inhibitor of p300/CBP with IC50s of 9.8 nM and 2.6 nM for p300 and CBP histone acetyltransferase (HAT), respectively.

CAS Number	1889279-16-6
PubChem CID	118958122
IUPAC Name	N-[(4-fluorophenyl)methyl]-2-[(3R)-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]acetamide
Molecular Formula	C25H24F4N4O5
Molecular Weight	536.5
XLogP	3.3
Topological Polar Surface Area	108
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	6
Heavy Atom Count	38
Formal Charge	0
Complexity	941

SMILES

C[C@@H](C(F)(F)F)N(CC1=CC=C(C=C1)F)C(=O)CN2C(=O)[C@]3(CCC4=C3C=CC(=C4)NC(=O)NC)OC2=O

InChI

InChI=1S/C25H24F4N4O5/c1-14(25(27,28)29)32(12-15-3-5-17(26)6-4-15)20(34)13-33-21(35)24(38-23(33)37)10-9-16-11-18(7-8-19(16)24)31-22(36)30-2/h3-8,11,14H,9-10,12-13H2,1-2H3,(H2,30,31,36)/t14-,24+/m0/s1

InChIKey

VRVJKILQRBSEAG-LFPIHBKWSA-N

Chemical Structure

2D Structure

CAS: 1889279-16-6

CID: 118958122

Formula: C25H24F4N4O5

MW: 536.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	536.5
XLogP3	3.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	6
Exact Mass	536.16828253
Monoisotopic Mass	536.16828253
Topological Polar Surface Area	108 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	941
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
BA4653-5	A-485
BA166476-01	A 485
A16830-50	A-485 50mg

A-485

Chemical Information

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