P970-0179 Screening compound: 2-(3-chlorophenoxy)-N-[(oxan-4-yl)methyl]acetamide

P970-0179 Screening compound: 2-(3-chlorophenoxy)-N-[(oxan-4-yl)methyl]acetamide
P970-0179 Screening compound: 2-(3-chlorophenoxy)-N-[(oxan-4-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P970-0179
2-(3-chlorophenoxy)-N-[(oxan-4-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

P970-0179

Molecular Formula

C14H18ClNO3 (C14 H18 ClNO3)

Compound Name

2-(3-chlorophenoxy)-N-[(oxan-4-yl)methyl]acetamide

IUPAC name

2-(3-chlorophenoxy)-N-[(oxan-4-yl)methyl]acetamide

SMILES

O=C(COc1cccc(Cl)c1)NCC1CCOCC1

InChI

InChI=1S/C14H18ClNO3/c15-12-2-1-3-13(8-12)19-10-14(17)16-9-11-4-6-18-7-5-11/h1-3,8,11H,4-7,9-10H2,(H,16,17)

InChI Key

HVKIBGGGSZOFBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28995354

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.75

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

2.417

Distribution Coefficient, logD

2.417

Water Solubility, LogSw

-2.99

Polar Surface Area

40.038

Acid Dissociation Constant (pKa)

14.74

Base Dissociation Constant (pKb)

5.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P970-0179 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P970-0179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P970-0179?
Check Price and Availability of P970-0179, 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 P970-0179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P970-0179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P970-0179
  • 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 P970-0179 available by request