1688-0207 Screening compound: 4-tert-butyl-N-(4-{[3-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide

1688-0207 Screening compound: 4-tert-butyl-N-(4-{[3-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide
1688-0207 Screening compound: 4-tert-butyl-N-(4-{[3-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1688-0207
4-tert-butyl-N-(4-{[3-(trifluoromethyl)phenyl]carbamoyl}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

1688-0207

Molecular Formula

C25H23F3N2O2 (C25 H23 F3 N2 O2)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(C)c(cc1)ccc1C(Nc(cc1)ccc1C(Nc1cccc(C(F)(F)F)c1)=O)=O

InChI

InChI=1S/C25H23F3N2O2/c1-24(2,3)18-11-7-16(8-12-18)22(31)29-20-13-9-17(10-14-20)23(32)30-21-6-4-5-19(15-21)25(26,27)28/h4-15H,1-3H3,(H,29,31)(H,30,32)

InChI Key

UTBFDWSHCFKBAQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01040505

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.690

Distribution Coefficient, logD

6.663

Water Solubility, LogSw

-5.86

Polar Surface Area

46.421

Acid Dissociation Constant (pKa)

8.60

Base Dissociation Constant (pKb)

-1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

1688-0207 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1688-0207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1688-0207?
Check Price and Availability of 1688-0207, 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 1688-0207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1688-0207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1688-0207
  • 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 1688-0207 available by request