8010-0067 Screening compound: 2-(2-imino-6-methoxy-2,3-dihydro-1,3-benzothiazol-3-yl)ethan-1-ol

8010-0067 Screening compound: 2-(2-imino-6-methoxy-2,3-dihydro-1,3-benzothiazol-3-yl)ethan-1-ol
8010-0067 Screening compound: 2-(2-imino-6-methoxy-2,3-dihydro-1,3-benzothiazol-3-yl)ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-0067
2-(2-imino-6-methoxy-2,3-dihydro-1,3-benzothiazol-3-yl)ethan-1-ol

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

8010-0067

Molecular Formula

C10H12N2O2S (C10 H12 N2 O2 S)

Compound Name

2-(2-imino-6-methoxy-2,3-dihydro-1,3-benzothiazol-3-yl)ethan-1-ol

IUPAC name

2-(2-imino-6-methoxy-23-dihydro-13-benzothiazol-3-yl)ethan-1-ol

SMILES

COc(cc1)cc(S2)c1N(CCO)C2=N

InChI

InChI=1S/C10H12N2O2S/c1-14-7-2-3-8-9(6-7)15-10(11)12(8)4-5-13/h2-3,6,11,13H,4-5H2,1H3

InChI Key

OEBOKWNQOQWGSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02069470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

224.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.334

Distribution Coefficient, logD

1.332

Water Solubility, LogSw

-2.26

Polar Surface Area

44.645

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

4.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

8010-0067 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8010-0067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-0067?
Check Price and Availability of 8010-0067, 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 8010-0067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-0067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-0067
  • 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 8010-0067 available by request