C094-0408 Screening compound: 2-(4-methylphenyl)-N-[4-(propan-2-yl)phenyl]-2-[2-(thiophen-2-yl)acetamido]acetamide

C094-0408 Screening compound: 2-(4-methylphenyl)-N-[4-(propan-2-yl)phenyl]-2-[2-(thiophen-2-yl)acetamido]acetamide
C094-0408 Screening compound: 2-(4-methylphenyl)-N-[4-(propan-2-yl)phenyl]-2-[2-(thiophen-2-yl)acetamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C094-0408
2-(4-methylphenyl)-N-[4-(propan-2-yl)phenyl]-2-[2-(thiophen-2-yl)acetamido]acetamide

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

C094-0408

Molecular Formula

C24H26N2O2S (C24 H26 N2 O2 S)

Compound Name

2-(4-methylphenyl)-N-[4-(propan-2-yl)phenyl]-2-[2-(thiophen-2-yl)acetamido]acetamide

IUPAC name

2-(4-methylphenyl)-N-[4-(propan-2-yl)phenyl]-2-[2-(thiophen-2-yl)acetamido]acetamide

SMILES

CC(C)c(cc1)ccc1NC(C(c1ccc(C)cc1)NC(Cc1cccs1)=O)=O

InChI

InChI=1S/C24H26N2O2S/c1-16(2)18-10-12-20(13-11-18)25-24(28)23(19-8-6-17(3)7-9-19)26-22(27)15-21-5-4-14-29-21/h4-14,16,23H,15H2,1-3H3,(H,25,28)(H,26,27)/t23-/m1/s1

InChI Key

NVIATWLNBZHMHN-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD03449833

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.665

Distribution Coefficient, logD

4.665

Water Solubility, LogSw

-4.34

Polar Surface Area

47.900

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

0.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

C094-0408 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C094-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C094-0408?
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What is the minimum amount of C094-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C094-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C094-0408
  • 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 C094-0408 available by request