8011-8066 Screening compound: N-benzyl-N-[1-methyl-1-(phenylcarbamoyl)ethyl]-2-(2,4,5-trichlorophenoxy)propanamide

8011-8066 Screening compound: N-benzyl-N-[1-methyl-1-(phenylcarbamoyl)ethyl]-2-(2,4,5-trichlorophenoxy)propanamide
8011-8066 Screening compound: N-benzyl-N-[1-methyl-1-(phenylcarbamoyl)ethyl]-2-(2,4,5-trichlorophenoxy)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-8066
N-benzyl-N-[1-methyl-1-(phenylcarbamoyl)ethyl]-2-(2,4,5-trichlorophenoxy)propanamide

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

8011-8066

Molecular Formula

C26H25Cl3N2O3 (C26 H25 Cl3 N2 O3)

Compound Name

N-benzyl-N-[1-methyl-1-(phenylcarbamoyl)ethyl]-2-(2,4,5-trichlorophenoxy)propanamide

IUPAC name

N-benzyl-N-[1-methyl-1-(phenylcarbamoyl)ethyl]-2-(245-trichlorophenoxy)propanamide

SMILES

CC(C(N(Cc1ccccc1)C(C)(C)C(Nc1ccccc1)=O)=O)Oc(c(Cl)c1)cc(Cl)c1Cl

InChI

InChI=1S/C26H25Cl3N2O3/c1-17(34-23-15-21(28)20(27)14-22(23)29)24(32)31(16-18-10-6-4-7-11-18)26(2,3)25(33)30-19-12-8-5-9-13-19/h4-15,17H,16H2,1-3H3,(H,30,33)/t17-/m0/s1

InChI Key

OFYLXDNEMRSXJA-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD02933230

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

519.85

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

6.849

Distribution Coefficient, logD

6.849

Water Solubility, LogSw

-6.28

Polar Surface Area

46.143

Acid Dissociation Constant (pKa)

12.04

Base Dissociation Constant (pKb)

1.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with 8011-8066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-8066?
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What is the minimum amount of 8011-8066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-8066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-8066
  • 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 8011-8066 available by request