C626-0217 Screening compound: N-[2-(3-methylphenyl)ethyl]-2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}acetamide

C626-0217 Screening compound: N-[2-(3-methylphenyl)ethyl]-2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}acetamide
C626-0217 Screening compound: N-[2-(3-methylphenyl)ethyl]-2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C626-0217
N-[2-(3-methylphenyl)ethyl]-2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}acetamide

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

C626-0217

Molecular Formula

C26H34N4O3S (C26 H34 N4 O3 S)

Compound Name

N-[2-(3-methylphenyl)ethyl]-2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}acetamide

IUPAC name

N-[2-(3-methylphenyl)ethyl]-2-{N-[4-(propan-2-yl)phenyl]135-trimethyl-1H-pyrazole-4-sulfonamido}acetamide

SMILES

CC(C)c(cc1)ccc1N(CC(NCCc1cc(C)ccc1)=O)S(c1c(C)n(C)nc1C)(=O)=O

InChI

InChI=1S/C26H34N4O3S/c1-18(2)23-10-12-24(13-11-23)30(34(32,33)26-20(4)28-29(6)21(26)5)17-25(31)27-15-14-22-9-7-8-19(3)16-22/h7-13,16,18H,14-15,17H2,1-6H3,(H,27,31)

InChI Key

MQBUPGZWVOPZHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14778269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.500

Distribution Coefficient, logD

3.500

Water Solubility, LogSw

-3.84

Polar Surface Area

70.945

Acid Dissociation Constant (pKa)

14.59

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

C626-0217 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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 C626-0217 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C626-0217?
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What is the minimum amount of C626-0217 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C626-0217
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C626-0217
  • 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 C626-0217 available by request