6704-0025F Screening compound: 2,3,5-trifluoro-4-methoxy-6-[(2-methylphenyl)amino]benzoic acid

6704-0025F Screening compound: 2,3,5-trifluoro-4-methoxy-6-[(2-methylphenyl)amino]benzoic acid
6704-0025F Screening compound: 2,3,5-trifluoro-4-methoxy-6-[(2-methylphenyl)amino]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6704-0025F
2,3,5-trifluoro-4-methoxy-6-[(2-methylphenyl)amino]benzoic acid

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

6704-0025F

Molecular Formula

C15H12F3NO3 (C15 H12 F3 NO3)

Compound Name

2,3,5-trifluoro-4-methoxy-6-[(2-methylphenyl)amino]benzoic acid

IUPAC name

235-trifluoro-4-methoxy-6-[(2-methylphenyl)amino]benzoic acid

SMILES

Cc(cccc1)c1Nc(c(F)c1OC)c(C(O)=O)c(F)c1F

InChI

InChI=1S/C15H12F3NO3/c1-7-5-3-4-6-8(7)19-13-9(15(20)21)10(16)11(17)14(22-2)12(13)18/h3-6,19H,1-2H3,(H,20,21)

InChI Key

YVTGRYLRQNYGED-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

311.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.826

Distribution Coefficient, logD

-0.499

Water Solubility, LogSw

-4.21

Polar Surface Area

43.183

Acid Dissociation Constant (pKa)

3.07

Base Dissociation Constant (pKb)

-4.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

References: we are preparing a list of scientific research reports with 6704-0025F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6704-0025F?
Check Price and Availability of 6704-0025F, 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 6704-0025F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6704-0025F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6704-0025F
  • 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 6704-0025F available by request