5547-0668 Screening compound: 4-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)-3-methyl-1H-pyrazol-5-ol

5547-0668 Screening compound: 4-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)-3-methyl-1H-pyrazol-5-ol
5547-0668 Screening compound: 4-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)-3-methyl-1H-pyrazol-5-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 5547-0668
4-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)-3-methyl-1H-pyrazol-5-ol

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

5547-0668

Molecular Formula

C23H23FN4O4 (C23 H23 FN4 O4)

Compound Name

4-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)-3-methyl-1H-pyrazol-5-ol

IUPAC name

4-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)-3-methyl-1H-pyrazol-5-ol

SMILES

Cc1n[nH]c(O)c1C(c(c(C)n[nH]1)c1O)c(cc1)cc(OC)c1OCc(cccc1)c1F

InChI

InChI=1S/C23H23FN4O4/c1-12-19(22(29)27-25-12)21(20-13(2)26-28-23(20)30)14-8-9-17(18(10-14)31-3)32-11-15-6-4-5-7-16(15)24/h4-10,21H,11H2,1-3H3,(H2,25,27,29)(H2,26,28,30)

InChI Key

FKUQPMDQZLZXTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03044105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.652

Distribution Coefficient, logD

2.430

Water Solubility, LogSw

-2.79

Polar Surface Area

95.237

Acid Dissociation Constant (pKa)

7.57

Base Dissociation Constant (pKb)

3.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

5547-0668 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5547-0668 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5547-0668?
Check Price and Availability of 5547-0668, 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 5547-0668 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5547-0668
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5547-0668
  • 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 5547-0668 available by request