Y021-2270 Screening compound: 5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazol-4-yl cyanide

Y021-2270 Screening compound: 5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazol-4-yl cyanide
Y021-2270 Screening compound: 5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazol-4-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-2270
5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazol-4-yl cyanide

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

Y021-2270

Molecular Formula

C11H7N5S (C11 H7 N5 S)

Compound Name

5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazol-4-yl cyanide

IUPAC name

5-amino-1-(13-benzothiazol-2-yl)-1H-pyrazole-4-carbonitrile

SMILES

Nc(n(-c1nc(cccc2)c2s1)nc1)c1C#N

InChI

InChI=1S/C11H7N5S/c12-5-7-6-14-16(10(7)13)11-15-8-3-1-2-4-9(8)17-11/h1-4,6H,13H2

InChI Key

QNGNVSDIXHKKFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01124456

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

241.28

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.356

Distribution Coefficient, logD

2.356

Water Solubility, LogSw

-2.52

Polar Surface Area

60.146

Acid Dissociation Constant (pKa)

18.97

Base Dissociation Constant (pKb)

2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y021-2270 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y021-2270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-2270?
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What is the minimum amount of Y021-2270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-2270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-2270
  • 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 Y021-2270 available by request