1711-1156 Screening compound: 3-(2-bromoacetyl)-6-chloro-2H-chromen-2-one

1711-1156 Screening compound: 3-(2-bromoacetyl)-6-chloro-2H-chromen-2-one
1711-1156 Screening compound: 3-(2-bromoacetyl)-6-chloro-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1711-1156
3-(2-bromoacetyl)-6-chloro-2H-chromen-2-one

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

1711-1156

Molecular Formula

C11H6BrClO3 (C11 H6 BrClO3)

Compound Name

3-(2-bromoacetyl)-6-chloro-2H-chromen-2-one

IUPAC name

3-(2-bromoacetyl)-6-chloro-2H-chromen-2-one

SMILES

O=C(CBr)C1=Cc(cc(cc2)Cl)c2OC1=O

InChI

InChI=1S/C11H6BrClO3/c12-5-9(14)8-4-6-3-7(13)1-2-10(6)16-11(8)15/h1-4H,5H2

InChI Key

FYYJITRCFASIRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00768657

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.651

Distribution Coefficient, logD

2.651

Water Solubility, LogSw

-3.24

Polar Surface Area

34.407

Acid Dissociation Constant (pKa)

20.14

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

1711-1156 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 1711-1156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1711-1156?
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What is the minimum amount of 1711-1156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1711-1156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1711-1156
  • 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 1711-1156 available by request