C453-0312 Screening compound: 1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]-4-propylpiperazine

C453-0312 Screening compound: 1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]-4-propylpiperazine
C453-0312 Screening compound: 1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]-4-propylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C453-0312
1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]-4-propylpiperazine

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

C453-0312

Molecular Formula

C22H28N4O3S (C22 H28 N4 O3 S)

Compound Name

1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]-4-propylpiperazine

IUPAC name

1-[3-(34-dimethoxyphenyl)-1-methyl-1H-thieno[23-c]pyrazole-5-carbonyl]-4-propylpiperazine

SMILES

CCCN(CC1)CCN1C(c1cc(c(-c(cc2)cc(OC)c2OC)nn2C)c2s1)=O

InChI

InChI=1S/C22H28N4O3S/c1-5-8-25-9-11-26(12-10-25)21(27)19-14-16-20(23-24(2)22(16)30-19)15-6-7-17(28-3)18(13-15)29-4/h6-7,13-14H,5,8-12H2,1-4H3

InChI Key

YCBKYPBNWDNEAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14759695

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.849

Distribution Coefficient, logD

2.673

Water Solubility, LogSw

-3.12

Polar Surface Area

51.056

Acid Dissociation Constant (pKa)

27.99

Base Dissociation Constant (pKb)

7.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

C453-0312 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 C453-0312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C453-0312?
Check Price and Availability of C453-0312, 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 C453-0312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C453-0312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C453-0312
  • 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 C453-0312 available by request