Y020-1344 Screening compound: 3'-(4-hydroxyphenyl)-4,4,6,8-tetramethyl-4H,4'H-spiro[pyrrolo[3,2,1-ij]quinoline-1,2'-[1,3]thiazolidine]-2,4'-dione

Chemical Structure Depiction of ChemDiv screening compound Y020-1344
3'-(4-hydroxyphenyl)-4,4,6,8-tetramethyl-4H,4'H-spiro[pyrrolo[3,2,1-ij]quinoline-1,2'-[1,3]thiazolidine]-2,4'-dione

Available from 1 mg

Formats:

Glass Vials (4ml Glass Vials VWR #97047-678)
96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

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Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y020-1344

Molecular Formula

C₂₃H₂₂N₂O₃S (C23 H22 N2 O3 S)

Compound Name

3'-(4-hydroxyphenyl)-4,4,6,8-tetramethyl-4H,4'H-spiro[pyrrolo[3,2,1-ij]quinoline-1,2'-[1,3]thiazolidine]-2,4'-dione

IUPAC name

3-(4-hydroxyphenyl)-5'5'7'10'-tetramethyl-4'-azaspiro[13-thiazolidine-22'-tricyclo[6.3.1.0^{412}]dodecane]-1'(11')6'8'(12')9'-tetraene-3'4-dione

SMILES

CC1(C)N(C(C2(N3c(cc4)ccc4O)SCC3=O)=O)c3c2cc(C)cc3C(C)=C1

InChI

InChI=1S/C23H22N2O3S/c1-13-9-17-14(2)11-22(3,4)25-20(17)18(10-13)23(21(25)28)24(19(27)12-29-23)15-5-7-16(26)8-6-15/h5-11,26H,12H2,1-4H3/t23-/m0/s1

InChI Key

PQUSMSKDJBVHID-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD06608448

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

Partition Coefficient, logP

3.825

Distribution Coefficient, logD

3.825

Water Solubility, LogSw

-3.98

Polar Surface Area

49.638

Acid Dissociation Constant (pK_a)

10.53

Base Dissociation Constant (pK_b)

-4.62

Number of Chiral Centers

1.00

Percent sp³ carbon bonding

30.40

Y020-1344 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human GPCR Annotated Library (5539 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:

3D
Cyclic compounds
Cyclic compounds

Therapeutical areas:

Hemic and lymphatic
Cardiovascular
Cancer
Musculoskeletal
Digestive system
Respiratory tract
Male
Female
Hemic and lymphatic
Metabolic

Targets:

Others

Mechanism of action:

Epigenetic
PPI modulators
PPI modulators

Agro:

Agro

References: we are preparing a list of scientific research reports with Y020-1344 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1344?
Check Price and Availability of Y020-1344, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.

What is the minimum amount of Y020-1344 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.

Delivery options for Y020-1344
ChemDiv sends parcels with Express services (UPS, WC).

1–2 days for small orders
2–4 weeks for large selections

Delivery formats for Y020-1344

0.5–50 mg of dry powder sample in single glass vials, custom vials
DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y020-1344 available by request