Y020-5731 Screening compound: 3-(1,3-benzothiazol-2-yl)-1-(3-chlorophenyl)urea

Y020-5731 Screening compound: 3-(1,3-benzothiazol-2-yl)-1-(3-chlorophenyl)urea
Y020-5731 Screening compound: 3-(1,3-benzothiazol-2-yl)-1-(3-chlorophenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-5731
3-(1,3-benzothiazol-2-yl)-1-(3-chlorophenyl)urea

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

Y020-5731

Molecular Formula

C14H10ClN3OS (C14 H10 ClN3 OS)

Compound Name

3-(1,3-benzothiazol-2-yl)-1-(3-chlorophenyl)urea

IUPAC name

3-(13-benzothiazol-2-yl)-1-(3-chlorophenyl)urea

SMILES

O=C(Nc1nc(cccc2)c2s1)Nc1cccc(Cl)c1

InChI

InChI=1S/C14H10ClN3OS/c15-9-4-3-5-10(8-9)16-13(19)18-14-17-11-6-1-2-7-12(11)20-14/h1-8H,(H2,16,17,18,19)

InChI Key

KIJFMBMCWLDPPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00247430

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.77

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.131

Distribution Coefficient, logD

5.131

Water Solubility, LogSw

-5.56

Polar Surface Area

42.303

Acid Dissociation Constant (pKa)

11.30

Base Dissociation Constant (pKb)

0.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y020-5731 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

Anti-Aging Library (44940 compounds)

CORONAVIRUS Library (20774 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y020-5731 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-5731?
Check Price and Availability of Y020-5731, 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 Y020-5731 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-5731
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-5731
  • 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 Y020-5731 available by request