G789-2104 Screening compound: ethyl 4-[3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-amido]benzoate

G789-2104 Screening compound: ethyl 4-[3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-amido]benzoate
G789-2104 Screening compound: ethyl 4-[3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G789-2104
ethyl 4-[3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-amido]benzoate

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

G789-2104

Molecular Formula

C22H18ClN3O3S (C22 H18 ClN3 O3 S)

Compound Name

ethyl 4-[3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-amido]benzoate

IUPAC name

ethyl 4-[3-(4-chlorophenyl)-1-methyl-1H-thieno[23-c]pyrazole-5-amido]benzoate

SMILES

CCOC(c(cc1)ccc1NC(c1cc(c(-c(cc2)ccc2Cl)nn2C)c2s1)=O)=O

InChI

InChI=1S/C22H18ClN3O3S/c1-3-29-22(28)14-6-10-16(11-7-14)24-20(27)18-12-17-19(25-26(2)21(17)30-18)13-4-8-15(23)9-5-13/h4-12H,3H2,1-2H3,(H,24,27)

InChI Key

LTPFTNOTVCZRMM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27158105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.445

Distribution Coefficient, logD

5.444

Water Solubility, LogSw

-6.02

Polar Surface Area

59.201

Acid Dissociation Constant (pKa)

10.97

Base Dissociation Constant (pKb)

-1.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

G789-2104 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G789-2104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G789-2104?
Check Price and Availability of G789-2104, 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 G789-2104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G789-2104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G789-2104
  • 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 G789-2104 available by request