2889-5571 Screening compound: 2-(4-chlorophenoxy)-N-[(oxolan-2-yl)methyl]acetamide

2889-5571 Screening compound: 2-(4-chlorophenoxy)-N-[(oxolan-2-yl)methyl]acetamide
2889-5571 Screening compound: 2-(4-chlorophenoxy)-N-[(oxolan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2889-5571
2-(4-chlorophenoxy)-N-[(oxolan-2-yl)methyl]acetamide

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

2889-5571

Molecular Formula

C13H16ClNO3 (C13 H16 ClNO3)

Compound Name

2-(4-chlorophenoxy)-N-[(oxolan-2-yl)methyl]acetamide

IUPAC name

2-(4-chlorophenoxy)-N-[(oxolan-2-yl)methyl]acetamide

SMILES

O=C(COc(cc1)ccc1Cl)NCC1OCCC1

InChI

InChI=1S/C13H16ClNO3/c14-10-3-5-11(6-4-10)18-9-13(16)15-8-12-2-1-7-17-12/h3-6,12H,1-2,7-9H2,(H,15,16)/t12-/m1/s1

InChI Key

NXYDXDWIEHMNOX-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD00844550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.73

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.629

Distribution Coefficient, logD

1.629

Water Solubility, LogSw

-2.39

Polar Surface Area

40.592

Acid Dissociation Constant (pKa)

14.34

Base Dissociation Constant (pKb)

-0.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.15

2889-5571 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2889-5571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2889-5571?
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What is the minimum amount of 2889-5571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2889-5571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2889-5571
  • 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 2889-5571 available by request