8012-8271 Screening compound: ethyl 2H,3H-thieno[3,4-b][1,4]dioxine-5-carboxylate

8012-8271 Screening compound: ethyl 2H,3H-thieno[3,4-b][1,4]dioxine-5-carboxylate
8012-8271 Screening compound: ethyl 2H,3H-thieno[3,4-b][1,4]dioxine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-8271
ethyl 2H,3H-thieno[3,4-b][1,4]dioxine-5-carboxylate

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

8012-8271

Molecular Formula

C9H10O4S (C9 H10 O4 S)

Compound Name

ethyl 2H,3H-thieno[3,4-b][1,4]dioxine-5-carboxylate

IUPAC name

ethyl 2H3H-thieno[34-b][14]dioxine-5-carboxylate

SMILES

CCOC(c1c2OCCOc2cs1)=O

InChI

InChI=1S/C9H10O4S/c1-2-11-9(10)8-7-6(5-14-8)12-3-4-13-7/h5H,2-4H2,1H3

InChI Key

WGKIXRIZQOQWTB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03307997

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

214.24

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.662

Distribution Coefficient, logD

1.662

Water Solubility, LogSw

-1.76

Polar Surface Area

37.518

Acid Dissociation Constant (pKa)

30.24

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

8012-8271 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8012-8271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-8271?
Check Price and Availability of 8012-8271, 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 8012-8271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-8271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-8271
  • 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 8012-8271 available by request