0630-0075 Screening compound: 2-{[1,1'-biphenyl]-4-yl}-5-(4-heptylphenyl)-1,3,4-oxadiazole

0630-0075 Screening compound: 2-{[1,1'-biphenyl]-4-yl}-5-(4-heptylphenyl)-1,3,4-oxadiazole
0630-0075 Screening compound: 2-{[1,1'-biphenyl]-4-yl}-5-(4-heptylphenyl)-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0630-0075
2-{[1,1'-biphenyl]-4-yl}-5-(4-heptylphenyl)-1,3,4-oxadiazole

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

0630-0075

Molecular Formula

C27H28N2O (C27 H28 N2 O)

Compound Name

2-{[1,1'-biphenyl]-4-yl}-5-(4-heptylphenyl)-1,3,4-oxadiazole

IUPAC name

2-{[11'-biphenyl]-4-yl}-5-(4-heptylphenyl)-134-oxadiazole

SMILES

CCCCCCCc(cc1)ccc1-c1nnc(-c(cc2)ccc2-c2ccccc2)o1

InChI

InChI=1S/C27H28N2O/c1-2-3-4-5-7-10-21-13-15-24(16-14-21)26-28-29-27(30-26)25-19-17-23(18-20-25)22-11-8-6-9-12-22/h6,8-9,11-20H,2-5,7,10H2,1H3

InChI Key

XEUJZMUWRZGAAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00642531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.53

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

8.697

Distribution Coefficient, logD

8.697

Water Solubility, LogSw

-5.94

Polar Surface Area

30.211

Acid Dissociation Constant (pKa)

26.39

Base Dissociation Constant (pKb)

-4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

0630-0075 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0630-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0630-0075?
Check Price and Availability of 0630-0075, 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 0630-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0630-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0630-0075
  • 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 0630-0075 available by request