Y020-7101 Screening compound: 1-(1,3-benzothiazol-2-yl)-3,3-dimethylthiourea

Y020-7101 Screening compound: 1-(1,3-benzothiazol-2-yl)-3,3-dimethylthiourea
Y020-7101 Screening compound: 1-(1,3-benzothiazol-2-yl)-3,3-dimethylthiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-7101
1-(1,3-benzothiazol-2-yl)-3,3-dimethylthiourea

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

Y020-7101

Molecular Formula

C10H11N3S2 (C10 H11 N3 S2)

Compound Name

1-(1,3-benzothiazol-2-yl)-3,3-dimethylthiourea

IUPAC name

1-(13-benzothiazol-2-yl)-33-dimethylthiourea

SMILES

CN(C)C(Nc1nc(cccc2)c2s1)=S

InChI

InChI=1S/C10H11N3S2/c1-13(2)10(14)12-9-11-7-5-3-4-6-8(7)15-9/h3-6H,1-2H3,(H,11,12,14)

InChI Key

SHKIAKVYCNVNHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04194895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

237.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.878

Distribution Coefficient, logD

2.878

Water Solubility, LogSw

-3.12

Polar Surface Area

20.250

Acid Dissociation Constant (pKa)

12.78

Base Dissociation Constant (pKb)

3.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

Y020-7101 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y020-7101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-7101?
Check Price and Availability of Y020-7101, 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 Y020-7101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-7101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-7101
  • 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 Y020-7101 available by request