0074-0006 Screening compound: 5-octyl-2-[4'-(octyloxy)-[1,1'-biphenyl]-4-yl]pyrimidine

0074-0006 Screening compound: 5-octyl-2-[4'-(octyloxy)-[1,1'-biphenyl]-4-yl]pyrimidine
0074-0006 Screening compound: 5-octyl-2-[4'-(octyloxy)-[1,1'-biphenyl]-4-yl]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0074-0006
5-octyl-2-[4'-(octyloxy)-[1,1'-biphenyl]-4-yl]pyrimidine

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

0074-0006

Molecular Formula

C32H44N2O (C32 H44 N2 O)

Compound Name

5-octyl-2-[4'-(octyloxy)-[1,1'-biphenyl]-4-yl]pyrimidine

IUPAC name

5-octyl-2-[4'-(octyloxy)-[11'-biphenyl]-4-yl]pyrimidine

SMILES

CCCCCCCCc1cnc(-c(cc2)ccc2-c(cc2)ccc2OCCCCCCCC)nc1

InChI

InChI=1S/C32H44N2O/c1-3-5-7-9-11-13-15-27-25-33-32(34-26-27)30-18-16-28(17-19-30)29-20-22-31(23-21-29)35-24-14-12-10-8-6-4-2/h16-23,25-26H,3-15,24H2,1-2H3

InChI Key

RQUMADKLKJPQHG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00598924

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.71

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

17.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

11.362

Distribution Coefficient, logD

11.362

Water Solubility, LogSw

-5.81

Polar Surface Area

26.728

Acid Dissociation Constant (pKa)

21.09

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 0074-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0074-0006?
Check Price and Availability of 0074-0006, 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 0074-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0074-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0074-0006
  • 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 0074-0006 available by request