4607-1641 Screening compound: 3-(3-METHOXYPHENYL)-1-(5-METHYLFURAN-2-CARBONYL)-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-PYRAZOL-5-OL

4607-1641 Screening compound: 3-(3-METHOXYPHENYL)-1-(5-METHYLFURAN-2-CARBONYL)-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-PYRAZOL-5-OL
4607-1641 Screening compound: 3-(3-METHOXYPHENYL)-1-(5-METHYLFURAN-2-CARBONYL)-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-PYRAZOL-5-OL alternative view

Chemical Structure Depiction of ChemDiv screening compound 4607-1641
3-(3-METHOXYPHENYL)-1-(5-METHYLFURAN-2-CARBONYL)-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-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

4607-1641

Molecular Formula

C17H15F3N2O4 (C17 H15 F3 N2 O4)

Compound Name

3-(3-METHOXYPHENYL)-1-(5-METHYLFURAN-2-CARBONYL)-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-PYRAZOL-5-OL

IUPAC name

n/a

SMILES

Cc1ccc(C(N(C(C2)(C(F)(F)F)O)N=C2c2cc(OC)ccc2)=O)o1

InChI

InChI=1S/C17H15F3N2O4/c1-10-6-7-14(26-10)15(23)22-16(24,17(18,19)20)9-13(21-22)11-4-3-5-12(8-11)25-2/h3-8,24H,9H2,1-2H3/t16-/m0/s1

InChI Key

FQOZQDKTVSAADQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD02912332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.207

Distribution Coefficient, logD

3.207

Water Solubility, LogSw

-3.27

Polar Surface Area

59.154

Acid Dissociation Constant (pKa)

11.45

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

7.00

4607-1641 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4607-1641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4607-1641?
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What is the minimum amount of 4607-1641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4607-1641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4607-1641
  • 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 4607-1641 available by request