C626-0019 Screening compound: 2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}-N-[(pyridin-3-yl)methyl]acetamide

C626-0019 Screening compound: 2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}-N-[(pyridin-3-yl)methyl]acetamide
C626-0019 Screening compound: 2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}-N-[(pyridin-3-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C626-0019
2-{N-[4-(propan-2-yl)phenyl]1,3,5-trimethyl-1H-pyrazole-4-sulfonamido}-N-[(pyridin-3-yl)methyl]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

C626-0019

Molecular Formula

C23H29N5O3S (C23 H29 N5 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)c(cc1)ccc1N(CC(NCc1cnccc1)=O)S(c1c(C)n(C)nc1C)(=O)=O

InChI

InChI=1S/C23H29N5O3S/c1-16(2)20-8-10-21(11-9-20)28(15-22(29)25-14-19-7-6-12-24-13-19)32(30,31)23-17(3)26-27(5)18(23)4/h6-13,16H,14-15H2,1-5H3,(H,25,29)

InChI Key

KJFMDRHPIMCJAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14778188

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.907

Distribution Coefficient, logD

1.905

Water Solubility, LogSw

-2.16

Polar Surface Area

80.621

Acid Dissociation Constant (pKa)

14.02

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

C626-0019 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C626-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C626-0019?
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What is the minimum amount of C626-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C626-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C626-0019
  • 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 C626-0019 available by request