1191-0610 Screening compound: 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-3-[(E)-2-(4-methoxyphenyl)-1-ethenyl]-4,5-dihydro-1H-pyrazole

1191-0610 Screening compound: 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-3-[(E)-2-(4-methoxyphenyl)-1-ethenyl]-4,5-dihydro-1H-pyrazole
1191-0610 Screening compound: 1-(2-fluorophenyl)-5-(4-methoxyphenyl)-3-[(E)-2-(4-methoxyphenyl)-1-ethenyl]-4,5-dihydro-1H-pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 1191-0610
1-(2-fluorophenyl)-5-(4-methoxyphenyl)-3-[(E)-2-(4-methoxyphenyl)-1-ethenyl]-4,5-dihydro-1H-pyrazole

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

1191-0610

Molecular Formula

C25H23FN2O2 (C25 H23 FN2 O2)

Compound Name

1-(2-fluorophenyl)-5-(4-methoxyphenyl)-3-[(E)-2-(4-methoxyphenyl)-1-ethenyl]-4,5-dihydro-1H-pyrazole

IUPAC name

n/a

SMILES

COc1ccc(C(C2)N(c(cccc3)c3F)N=C2/C=C/c(cc2)ccc2OC)cc1

InChI

InChI=1S/C25H23FN2O2/c1-29-21-13-8-18(9-14-21)7-12-20-17-25(19-10-15-22(30-2)16-11-19)28(27-20)24-6-4-3-5-23(24)26/h3-16,25H,17H2,1-2H3/t25-/m0/s1

InChI Key

MDZJVQJFMPAUHC-VWLOTQADSA-N

MDL Number (MFCD)

MFCD00986535

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.281

Distribution Coefficient, logD

6.281

Water Solubility, LogSw

-5.82

Polar Surface Area

28.609

Acid Dissociation Constant (pKa)

17.91

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

1191-0610 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 1191-0610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1191-0610?
Check Price and Availability of 1191-0610, 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 1191-0610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1191-0610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1191-0610
  • 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 1191-0610 available by request