1212-0010 Screening compound: ethyl 2-{[1,1'-biphenyl]-2-yloxy}acetate

1212-0010 Screening compound: ethyl 2-{[1,1'-biphenyl]-2-yloxy}acetate
1212-0010 Screening compound: ethyl 2-{[1,1'-biphenyl]-2-yloxy}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1212-0010
ethyl 2-{[1,1'-biphenyl]-2-yloxy}acetate

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

1212-0010

Molecular Formula

C16H16O3 (C16 H16 O3)

Compound Name

ethyl 2-{[1,1'-biphenyl]-2-yloxy}acetate

IUPAC name

ethyl 2-{[11'-biphenyl]-2-yloxy}acetate

SMILES

CCOC(COc(cccc1)c1-c1ccccc1)=O

InChI

InChI=1S/C16H16O3/c1-2-18-16(17)12-19-15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3

InChI Key

WJHXOCAUBKXUKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00807349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.441

Distribution Coefficient, logD

3.441

Water Solubility, LogSw

-3.66

Polar Surface Area

27.711

Acid Dissociation Constant (pKa)

24.97

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

1212-0010 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1212-0010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1212-0010?
Check Price and Availability of 1212-0010, 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 1212-0010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1212-0010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1212-0010
  • 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 1212-0010 available by request