C665-0240 Screening compound: ethyl 5-{[5-amino-3-(3,4,5-trimethoxyphenyl)-1H-pyrazol-1-yl]sulfonyl}-3-methyl-1-benzofuran-2-carboxylate

C665-0240 Screening compound: ethyl 5-{[5-amino-3-(3,4,5-trimethoxyphenyl)-1H-pyrazol-1-yl]sulfonyl}-3-methyl-1-benzofuran-2-carboxylate
C665-0240 Screening compound: ethyl 5-{[5-amino-3-(3,4,5-trimethoxyphenyl)-1H-pyrazol-1-yl]sulfonyl}-3-methyl-1-benzofuran-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C665-0240
ethyl 5-{[5-amino-3-(3,4,5-trimethoxyphenyl)-1H-pyrazol-1-yl]sulfonyl}-3-methyl-1-benzofuran-2-carboxylate

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

C665-0240

Molecular Formula

C24H25N3O8S (C24 H25 N3 O8 S)

Compound Name

ethyl 5-{[5-amino-3-(3,4,5-trimethoxyphenyl)-1H-pyrazol-1-yl]sulfonyl}-3-methyl-1-benzofuran-2-carboxylate

IUPAC name

ethyl 5-{[5-amino-3-(345-trimethoxyphenyl)-1H-pyrazol-1-yl]sulfonyl}-3-methyl-1-benzofuran-2-carboxylate

SMILES

CCOC(c1c(C)c(cc(cc2)S(n(c(N)c3)nc3-c(cc3OC)cc(OC)c3OC)(=O)=O)c2o1)=O

InChI

InChI=1S/C24H25N3O8S/c1-6-34-24(28)22-13(2)16-11-15(7-8-18(16)35-22)36(29,30)27-21(25)12-17(26-27)14-9-19(31-3)23(33-5)20(10-14)32-4/h7-12H,6,25H2,1-5H3

InChI Key

YPIRBKINHZUVCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780686

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

515.54

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.718

Distribution Coefficient, logD

3.718

Water Solubility, LogSw

-4.11

Polar Surface Area

112.453

Acid Dissociation Constant (pKa)

21.31

Base Dissociation Constant (pKb)

-4.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C665-0240 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with C665-0240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C665-0240?
Check Price and Availability of C665-0240, 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 C665-0240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C665-0240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C665-0240
  • 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 C665-0240 available by request