G789-0993 Screening compound: 1-(4-chlorophenyl)-N-(4-fluorophenyl)-N,3-dimethyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

G789-0993 Screening compound: 1-(4-chlorophenyl)-N-(4-fluorophenyl)-N,3-dimethyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
G789-0993 Screening compound: 1-(4-chlorophenyl)-N-(4-fluorophenyl)-N,3-dimethyl-1H-thieno[2,3-c]pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G789-0993
1-(4-chlorophenyl)-N-(4-fluorophenyl)-N,3-dimethyl-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

G789-0993

Molecular Formula

C20H15ClFN3OS (C20 H15 ClFN3 OS)

Compound Name

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

IUPAC name

1-(4-chlorophenyl)-N-(4-fluorophenyl)-N3-dimethyl-1H-thieno[23-c]pyrazole-5-carboxamide

SMILES

Cc(c1c2sc(C(N(C)c(cc3)ccc3F)=O)c1)nn2-c(cc1)ccc1Cl

InChI

InChI=1S/C20H15ClFN3OS/c1-12-17-11-18(19(26)24(2)15-9-5-14(22)6-10-15)27-20(17)25(23-12)16-7-3-13(21)4-8-16/h3-11H,1-2H3

InChI Key

QXBGOVPQDPJRIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27158049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.88

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.725

Distribution Coefficient, logD

4.725

Water Solubility, LogSw

-4.94

Polar Surface Area

30.382

Acid Dissociation Constant (pKa)

31.08

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

G789-0993 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G789-0993 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G789-0993?
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What is the minimum amount of G789-0993 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G789-0993
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G789-0993
  • 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 G789-0993 available by request