8519-0016 Screening compound: 2-methanesulfonyl-1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole

8519-0016 Screening compound: 2-methanesulfonyl-1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole
8519-0016 Screening compound: 2-methanesulfonyl-1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8519-0016
2-methanesulfonyl-1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole

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

8519-0016

Molecular Formula

C23H20N4O2S2 (C23 H20 N4 O2 S2)

Compound Name

2-methanesulfonyl-1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole

IUPAC name

2-methanesulfonyl-1'3'-diphenyl-5-(thiophen-2-yl)-34-dihydro-1'H2H-34'-bipyrazole

SMILES

CS(N(C(C1)c2cn(-c3ccccc3)nc2-c2ccccc2)N=C1c1cccs1)(=O)=O

InChI

InChI=1S/C23H20N4O2S2/c1-31(28,29)27-21(15-20(24-27)22-13-8-14-30-22)19-16-26(18-11-6-3-7-12-18)25-23(19)17-9-4-2-5-10-17/h2-14,16,21H,15H2,1H3/t21-/m0/s1

InChI Key

QLCXKXNKRZXDGY-NRFANRHFSA-N

MDL Number (MFCD)

MFCD07640318

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.595

Distribution Coefficient, logD

4.595

Water Solubility, LogSw

-4.34

Polar Surface Area

57.767

Acid Dissociation Constant (pKa)

12.42

Base Dissociation Constant (pKb)

-2.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with 8519-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8519-0016?
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What is the minimum amount of 8519-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8519-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8519-0016
  • 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 8519-0016 available by request