8010-1997 Screening compound: 3-[(octyloxy)carbonyl]-2,4-diphenylcyclobutane-1-carboxylic acid

8010-1997 Screening compound: 3-[(octyloxy)carbonyl]-2,4-diphenylcyclobutane-1-carboxylic acid
8010-1997 Screening compound: 3-[(octyloxy)carbonyl]-2,4-diphenylcyclobutane-1-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-1997
3-[(octyloxy)carbonyl]-2,4-diphenylcyclobutane-1-carboxylic acid

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

8010-1997

Molecular Formula

C26H32O4 (C26 H32 O4)

Compound Name

3-[(octyloxy)carbonyl]-2,4-diphenylcyclobutane-1-carboxylic acid

IUPAC name

3-[(octyloxy)carbonyl]-24-diphenylcyclobutane-1-carboxylic acid

SMILES

CCCCCCCCOC(C(C(C1C(O)=O)c2ccccc2)C1c1ccccc1)=O

InChI

InChI=1S/C26H32O4/c1-2-3-4-5-6-13-18-30-26(29)24-21(19-14-9-7-10-15-19)23(25(27)28)22(24)20-16-11-8-12-17-20/h7-12,14-17,21-24H,2-6,13,18H2,1H3,(H,27,28)

InChI Key

GGXSLJIBPXWBFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01061587

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.822

Distribution Coefficient, logD

4.059

Water Solubility, LogSw

-5.72

Polar Surface Area

49.674

Acid Dissociation Constant (pKa)

4.64

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.20

8010-1997 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8010-1997 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-1997?
Check Price and Availability of 8010-1997, 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 8010-1997 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-1997
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-1997
  • 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 8010-1997 available by request