C453-0433 Screening compound: N-(3-cyanophenyl)-3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

C453-0433 Screening compound: N-(3-cyanophenyl)-3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
C453-0433 Screening compound: N-(3-cyanophenyl)-3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C453-0433
N-(3-cyanophenyl)-3-(3,4-dimethoxyphenyl)-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

C453-0433

Molecular Formula

C22H18N4O3S (C22 H18 N4 O3 S)

Compound Name

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

IUPAC name

N-(3-cyanophenyl)-3-(34-dimethoxyphenyl)-1-methyl-1H-thieno[23-c]pyrazole-5-carboxamide

SMILES

Cn(c1c2cc(C(Nc3cc(C#N)ccc3)=O)s1)nc2-c(cc1)cc(OC)c1OC

InChI

InChI=1S/C22H18N4O3S/c1-26-22-16(20(25-26)14-7-8-17(28-2)18(10-14)29-3)11-19(30-22)21(27)24-15-6-4-5-13(9-15)12-23/h4-11H,1-3H3,(H,24,27)

InChI Key

QZUVBIOIDWOMGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14759738

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.820

Distribution Coefficient, logD

3.820

Water Solubility, LogSw

-4.20

Polar Surface Area

70.765

Acid Dissociation Constant (pKa)

10.85

Base Dissociation Constant (pKb)

-0.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

C453-0433 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer

References: we are preparing a list of scientific research reports with C453-0433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C453-0433?
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What is the minimum amount of C453-0433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C453-0433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C453-0433
  • 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 C453-0433 available by request