C498-0937 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

C498-0937 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
C498-0937 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C498-0937
N-[(2,4-dimethoxyphenyl)methyl]-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

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

C498-0937

Molecular Formula

C22H20FN3O3S (C22 H20 FN3 O3 S)

Compound Name

N-[(2,4-dimethoxyphenyl)methyl]-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

IUPAC name

N-[(24-dimethoxyphenyl)methyl]-3-(2-fluorophenyl)-1-methyl-1H-thieno[23-c]pyrazole-5-carboxamide

SMILES

Cn(c1c2cc(C(NCc(ccc(OC)c3)c3OC)=O)s1)nc2-c(cccc1)c1F

InChI

InChI=1S/C22H20FN3O3S/c1-26-22-16(20(25-26)15-6-4-5-7-17(15)23)11-19(30-22)21(27)24-12-13-8-9-14(28-2)10-18(13)29-3/h4-11H,12H2,1-3H3,(H,24,27)

InChI Key

KNSIWJMPAAWKIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14762300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.090

Distribution Coefficient, logD

4.090

Water Solubility, LogSw

-4.37

Polar Surface Area

54.944

Acid Dissociation Constant (pKa)

14.16

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

C498-0937 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C498-0937 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C498-0937?
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What is the minimum amount of C498-0937 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C498-0937
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C498-0937
  • 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 C498-0937 available by request