0200-5194 Screening compound: pyridin-3-yl 4-(4-pentylcyclohexyl)benzoate

0200-5194 Screening compound: pyridin-3-yl 4-(4-pentylcyclohexyl)benzoate
0200-5194 Screening compound: pyridin-3-yl 4-(4-pentylcyclohexyl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0200-5194
pyridin-3-yl 4-(4-pentylcyclohexyl)benzoate

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

0200-5194

Molecular Formula

C23H29NO2 (C23 H29 NO2)

Compound Name

pyridin-3-yl 4-(4-pentylcyclohexyl)benzoate

IUPAC name

pyridin-3-yl 4-(4-pentylcyclohexyl)benzoate

SMILES

CCCCCC(CC1)CCC1c(cc1)ccc1C(Oc1cnccc1)=O

InChI

InChI=1S/C23H29NO2/c1-2-3-4-6-18-8-10-19(11-9-18)20-12-14-21(15-13-20)23(25)26-22-7-5-16-24-17-22/h5,7,12-19H,2-4,6,8-11H2,1H3

InChI Key

JTVGXETYAXXJHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00983976

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.882

Distribution Coefficient, logD

6.882

Water Solubility, LogSw

-5.48

Polar Surface Area

30.055

Acid Dissociation Constant (pKa)

24.81

Base Dissociation Constant (pKb)

2.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

0200-5194 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 0200-5194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0200-5194?
Check Price and Availability of 0200-5194, 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 0200-5194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0200-5194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0200-5194
  • 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 0200-5194 available by request