C263-0312 Screening compound: 3-methyl-4-(4-methylbenzenesulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-cyclopentylpropanoate

C263-0312 Screening compound: 3-methyl-4-(4-methylbenzenesulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-cyclopentylpropanoate
C263-0312 Screening compound: 3-methyl-4-(4-methylbenzenesulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-cyclopentylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C263-0312
3-methyl-4-(4-methylbenzenesulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-cyclopentylpropanoate

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

C263-0312

Molecular Formula

C25H28N2O4S (C25 H28 N2 O4 S)

Compound Name

3-methyl-4-(4-methylbenzenesulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-cyclopentylpropanoate

IUPAC name

3-methyl-4-(4-methylbenzenesulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-cyclopentylpropanoate

SMILES

Cc(c(S(c1ccc(C)cc1)(=O)=O)c1OC(CCC2CCCC2)=O)nn1-c1ccccc1

InChI

InChI=1S/C25H28N2O4S/c1-18-12-15-22(16-13-18)32(29,30)24-19(2)26-27(21-10-4-3-5-11-21)25(24)31-23(28)17-14-20-8-6-7-9-20/h3-5,10-13,15-16,20H,6-9,14,17H2,1-2H3

InChI Key

IMXZTVFBNAYZHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04462105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.040

Distribution Coefficient, logD

5.040

Water Solubility, LogSw

-4.74

Polar Surface Area

64.014

Acid Dissociation Constant (pKa)

22.41

Base Dissociation Constant (pKb)

-3.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

C263-0312 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 C263-0312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C263-0312?
Check Price and Availability of C263-0312, 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 C263-0312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C263-0312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C263-0312
  • 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 C263-0312 available by request