8010-4922 Screening compound: 4-{1-[4-(3-methylbenzoyloxy)phenyl]cyclohexyl}phenyl 3-methylbenzoate

8010-4922 Screening compound: 4-{1-[4-(3-methylbenzoyloxy)phenyl]cyclohexyl}phenyl 3-methylbenzoate
8010-4922 Screening compound: 4-{1-[4-(3-methylbenzoyloxy)phenyl]cyclohexyl}phenyl 3-methylbenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-4922
4-{1-[4-(3-methylbenzoyloxy)phenyl]cyclohexyl}phenyl 3-methylbenzoate

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

8010-4922

Molecular Formula

C34H32O4 (C34 H32 O4)

Compound Name

4-{1-[4-(3-methylbenzoyloxy)phenyl]cyclohexyl}phenyl 3-methylbenzoate

IUPAC name

4-{1-[4-(3-methylbenzoyloxy)phenyl]cyclohexyl}phenyl 3-methylbenzoate

SMILES

Cc1cccc(C(Oc2ccc(C3(CCCCC3)c(cc3)ccc3OC(c3cc(C)ccc3)=O)cc2)=O)c1

InChI

InChI=1S/C34H32O4/c1-24-8-6-10-26(22-24)32(35)37-30-16-12-28(13-17-30)34(20-4-3-5-21-34)29-14-18-31(19-15-29)38-33(36)27-11-7-9-25(2)23-27/h6-19,22-23H,3-5,20-21H2,1-2H3

InChI Key

BVUSVFQMIKNBRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00311588

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.047

Distribution Coefficient, logD

8.047

Water Solubility, LogSw

-5.64

Polar Surface Area

40.643

Acid Dissociation Constant (pKa)

24.43

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

8010-4922 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8010-4922 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-4922?
Check Price and Availability of 8010-4922, 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 8010-4922 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-4922
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-4922
  • 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 8010-4922 available by request