D011-2191 Screening compound: 3-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1,3-benzoxazol-2-one

D011-2191 Screening compound: 3-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1,3-benzoxazol-2-one
D011-2191 Screening compound: 3-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1,3-benzoxazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D011-2191
3-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1,3-benzoxazol-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

D011-2191

Molecular Formula

C15H12ClNO3 (C15 H12 ClNO3)

Compound Name

3-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1,3-benzoxazol-2-one

IUPAC name

3-[2-(2-chlorophenoxy)ethyl]-23-dihydro-13-benzoxazol-2-one

SMILES

O=C1Oc(cccc2)c2N1CCOc(cccc1)c1Cl

InChI

InChI=1S/C15H12ClNO3/c16-11-5-1-3-7-13(11)19-10-9-17-12-6-2-4-8-14(12)20-15(17)18/h1-8H,9-10H2

InChI Key

OOLWAFFXEVRGQR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06333665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.72

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.581

Distribution Coefficient, logD

3.581

Water Solubility, LogSw

-3.76

Polar Surface Area

30.550

Acid Dissociation Constant (pKa)

27.44

Base Dissociation Constant (pKb)

-2.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

D011-2191 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with D011-2191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D011-2191?
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What is the minimum amount of D011-2191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D011-2191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D011-2191
  • 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 D011-2191 available by request