7884-5108 Screening compound: 2,5-dioxopyrrolidin-1-yl 3-chloro-1-benzothiophene-2-carboxylate

7884-5108 Screening compound: 2,5-dioxopyrrolidin-1-yl 3-chloro-1-benzothiophene-2-carboxylate
7884-5108 Screening compound: 2,5-dioxopyrrolidin-1-yl 3-chloro-1-benzothiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7884-5108
2,5-dioxopyrrolidin-1-yl 3-chloro-1-benzothiophene-2-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

7884-5108

Molecular Formula

C13H8ClNO4S (C13 H8 ClNO4 S)

Compound Name

2,5-dioxopyrrolidin-1-yl 3-chloro-1-benzothiophene-2-carboxylate

IUPAC name

25-dioxopyrrolidin-1-yl 3-chloro-1-benzothiophene-2-carboxylate

SMILES

O=C(c(sc1c2cccc1)c2Cl)ON(C(CC1)=O)C1=O

InChI

InChI=1S/C13H8ClNO4S/c14-11-7-3-1-2-4-8(7)20-12(11)13(18)19-15-9(16)5-6-10(15)17/h1-4H,5-6H2

InChI Key

VESAIHTZPLOAEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05621410

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.73

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.698

Distribution Coefficient, logD

1.698

Water Solubility, LogSw

-2.92

Polar Surface Area

53.966

Acid Dissociation Constant (pKa)

20.21

Base Dissociation Constant (pKb)

-4.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

7884-5108 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7884-5108 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7884-5108?
Check Price and Availability of 7884-5108, 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 7884-5108 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7884-5108
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7884-5108
  • 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 7884-5108 available by request