Y021-1205 Screening compound: 5-methanesulfonyl-6-(4-methoxyphenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridin-4-amine

Y021-1205 Screening compound: 5-methanesulfonyl-6-(4-methoxyphenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridin-4-amine
Y021-1205 Screening compound: 5-methanesulfonyl-6-(4-methoxyphenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-1205
5-methanesulfonyl-6-(4-methoxyphenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridin-4-amine

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)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y021-1205

Molecular Formula

C20H18N4O3S (C20 H18 N4 O3 S)

Compound Name

5-methanesulfonyl-6-(4-methoxyphenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridin-4-amine

IUPAC name

5-methanesulfonyl-6-(4-methoxyphenyl)-1-phenyl-1H-pyrazolo[34-b]pyridin-4-amine

SMILES

COc(cc1)ccc1-c(nc1n(-c2ccccc2)ncc1c1N)c1S(C)(=O)=O

InChI

InChI=1S/C20H18N4O3S/c1-27-15-10-8-13(9-11-15)18-19(28(2,25)26)17(21)16-12-22-24(20(16)23-18)14-6-4-3-5-7-14/h3-12H,1-2H3,(H2,21,23)

InChI Key

LRWCWHNJYYACFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31614884

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.602

Distribution Coefficient, logD

2.602

Water Solubility, LogSw

-2.97

Polar Surface Area

80.459

Acid Dissociation Constant (pKa)

19.94

Base Dissociation Constant (pKb)

1.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

Y021-1205 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with Y021-1205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-1205?
Check Price and Availability of Y021-1205, 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 Y021-1205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-1205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-1205
  • 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 Y021-1205 available by request