D341-2168 Screening compound: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(4-chloro-3,5-dimethylphenoxy)propanamide

D341-2168 Screening compound: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(4-chloro-3,5-dimethylphenoxy)propanamide
D341-2168 Screening compound: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(4-chloro-3,5-dimethylphenoxy)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D341-2168
N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(4-chloro-3,5-dimethylphenoxy)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

D341-2168

Molecular Formula

C24H21ClN2O3 (C24 H21 ClN2 O3)

Compound Name

N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(4-chloro-3,5-dimethylphenoxy)propanamide

IUPAC name

N-[3-(13-benzoxazol-2-yl)phenyl]-2-(4-chloro-35-dimethylphenoxy)propanamide

SMILES

CC(C(Nc1cc(-c2nc(cccc3)c3o2)ccc1)=O)Oc(cc1C)cc(C)c1Cl

InChI

InChI=1S/C24H21ClN2O3/c1-14-11-19(12-15(2)22(14)25)29-16(3)23(28)26-18-8-6-7-17(13-18)24-27-20-9-4-5-10-21(20)30-24/h4-13,16H,1-3H3,(H,26,28)/t16-/m0/s1

InChI Key

ZAFHFSOHIGJYSZ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD08550739

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.646

Distribution Coefficient, logD

6.646

Water Solubility, LogSw

-6.45

Polar Surface Area

46.929

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

1.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

D341-2168 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D341-2168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D341-2168?
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What is the minimum amount of D341-2168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D341-2168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D341-2168
  • 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 D341-2168 available by request