8007-6212 Screening compound: 4-(4-{[3-(trifluoromethyl)anilino]carbonyl}phenoxy)-N-[3-(trifluoromethyl)phenyl]benzamide

8007-6212 Screening compound: 4-(4-{[3-(trifluoromethyl)anilino]carbonyl}phenoxy)-N-[3-(trifluoromethyl)phenyl]benzamide
8007-6212 Screening compound: 4-(4-{[3-(trifluoromethyl)anilino]carbonyl}phenoxy)-N-[3-(trifluoromethyl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-6212
4-(4-{[3-(trifluoromethyl)anilino]carbonyl}phenoxy)-N-[3-(trifluoromethyl)phenyl]benzamide

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

8007-6212

Molecular Formula

C28H18F6N2O3 (C28 H18 F6 N2 O3)

Compound Name

4-(4-{[3-(trifluoromethyl)anilino]carbonyl}phenoxy)-N-[3-(trifluoromethyl)phenyl]benzamide

IUPAC name

N-[3-(trifluoromethyl)phenyl]-4-(4-{[3-(trifluoromethyl)phenyl]carbamoyl}phenoxy)benzamide

SMILES

O=C(c(cc1)ccc1Oc(cc1)ccc1C(Nc1cccc(C(F)(F)F)c1)=O)Nc1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C28H18F6N2O3/c29-27(30,31)19-3-1-5-21(15-19)35-25(37)17-7-11-23(12-8-17)39-24-13-9-18(10-14-24)26(38)36-22-6-2-4-20(16-22)28(32,33)34/h1-16H,(H,35,37)(H,36,38)

InChI Key

JVIGPQGPOHYQHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00314194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

544.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.657

Distribution Coefficient, logD

7.649

Water Solubility, LogSw

-6.41

Polar Surface Area

53.169

Acid Dissociation Constant (pKa)

9.11

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.14

References: we are preparing a list of scientific research reports with 8007-6212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-6212?
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What is the minimum amount of 8007-6212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-6212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-6212
  • 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 8007-6212 available by request