IU1-47

CAT: 0957-S6943-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0957-S6943-01Size:5 mg

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

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Description

IU1-47 is a potent and specific inhibitor of USP14 with an IC50 of 0.6 μM. IU1-47 shows ∼33-fold selectivity for USP14 over USP5 (IsoT) .

CAS Number

670270-31-2

Target

DUB

Activity

Ubiquitin

Molecular Formula

C19H23ClN2O

Storage Conditions

3 years -20°C powder

Chemical Information

1-(1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-(piperidin-1-yl)ethanone

CAS Number	670270-31-2
PubChem CID	675477
IUPAC Name	1-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]-2-piperidin-1-ylethanone
Molecular Formula	C19H23ClN2O
Molecular Weight	330.8
XLogP	4.3
Topological Polar Surface Area	25.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	23
Formal Charge	0
Complexity	402

SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C(=O)CN3CCCCC3

InChI

InChI=1S/C19H23ClN2O/c1-14-12-18(19(23)13-21-10-4-3-5-11-21)15(2)22(14)17-8-6-16(20)7-9-17/h6-9,12H,3-5,10-11,13H2,1-2H3

InChIKey

VXQIPRWKLACSKZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 670270-31-2

CID: 675477

Formula: C19H23ClN2O

MW: 330.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	330.8
XLogP3	4.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	330.1498911
Monoisotopic Mass	330.1498911
Topological Polar Surface Area	25.2 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	402
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