7610-2623 Screening compound: ethyl 4,5-dimethyl-2-[5-(thiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-amido]thiophene-3-carboxylate

7610-2623 Screening compound: ethyl 4,5-dimethyl-2-[5-(thiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-amido]thiophene-3-carboxylate
7610-2623 Screening compound: ethyl 4,5-dimethyl-2-[5-(thiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-amido]thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7610-2623
ethyl 4,5-dimethyl-2-[5-(thiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-amido]thiophene-3-carboxylate

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

7610-2623

Molecular Formula

C21H21F3N4O3S2 (C21 H21 F3 N4 O3 S2)

Compound Name

ethyl 4,5-dimethyl-2-[5-(thiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-amido]thiophene-3-carboxylate

IUPAC name

ethyl 45-dimethyl-2-[(5R7S)-5-(thiophen-2-yl)-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine-2-amido]thiophene-3-carboxylate

SMILES

CCOC(c1c(NC(c2nn([C@H](C[C@@H](c3cccs3)N3)C(F)(F)F)c3c2)=O)sc(C)c1C)=O

InChI

InChI=1S/C21H21F3N4O3S2/c1-4-31-20(30)17-10(2)11(3)33-19(17)26-18(29)13-9-16-25-12(14-6-5-7-32-14)8-15(21(22,23)24)28(16)27-13/h5-7,9,12,15,25H,4,8H2,1-3H3,(H,26,29)/t12-,15-/m1/s1

InChI Key

OGEASZXVZWLMSL-IUODEOHRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.764

Distribution Coefficient, logD

2.502

Water Solubility, LogSw

-4.59

Polar Surface Area

72.424

Acid Dissociation Constant (pKa)

5.14

Base Dissociation Constant (pKb)

-3.73

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

38.10

7610-2623 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 7610-2623 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7610-2623?
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What is the minimum amount of 7610-2623 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7610-2623
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7610-2623
  • 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 7610-2623 available by request