3366-4285 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-3,4,5-triethoxybenzamide

3366-4285 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-3,4,5-triethoxybenzamide
3366-4285 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-3,4,5-triethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3366-4285
N-[2-chloro-5-(trifluoromethyl)phenyl]-3,4,5-triethoxybenzamide

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

3366-4285

Molecular Formula

C20H21ClF3NO4 (C20 H21 ClF3 NO4)

Compound Name

N-[2-chloro-5-(trifluoromethyl)phenyl]-3,4,5-triethoxybenzamide

IUPAC name

N-[2-chloro-5-(trifluoromethyl)phenyl]-345-triethoxybenzamide

SMILES

CCOc1cc(C(Nc(cc(C(F)(F)F)cc2)c2Cl)=O)cc(OCC)c1OCC

InChI

InChI=1S/C20H21ClF3NO4/c1-4-27-16-9-12(10-17(28-5-2)18(16)29-6-3)19(26)25-15-11-13(20(22,23)24)7-8-14(15)21/h7-11H,4-6H2,1-3H3,(H,25,26)

InChI Key

TVPPATZFOJYBRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01355281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.184

Distribution Coefficient, logD

5.146

Water Solubility, LogSw

-5.76

Polar Surface Area

44.349

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

-3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with 3366-4285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3366-4285?
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What is the minimum amount of 3366-4285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3366-4285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3366-4285
  • 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 3366-4285 available by request