C094-2041 Screening compound: 2-(2-acetamidoacetamido)-N-(3-ethoxypropyl)-2-(4-methylphenyl)acetamide

C094-2041 Screening compound: 2-(2-acetamidoacetamido)-N-(3-ethoxypropyl)-2-(4-methylphenyl)acetamide
C094-2041 Screening compound: 2-(2-acetamidoacetamido)-N-(3-ethoxypropyl)-2-(4-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C094-2041
2-(2-acetamidoacetamido)-N-(3-ethoxypropyl)-2-(4-methylphenyl)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

C094-2041

Molecular Formula

C18H27N3O4 (C18 H27 N3 O4)

Compound Name

2-(2-acetamidoacetamido)-N-(3-ethoxypropyl)-2-(4-methylphenyl)acetamide

IUPAC name

2-(2-acetamidoacetamido)-N-(3-ethoxypropyl)-2-(4-methylphenyl)acetamide

SMILES

CCOCCCNC(C(c1ccc(C)cc1)NC(CNC(C)=O)=O)=O

InChI

InChI=1S/C18H27N3O4/c1-4-25-11-5-10-19-18(24)17(15-8-6-13(2)7-9-15)21-16(23)12-20-14(3)22/h6-9,17H,4-5,10-12H2,1-3H3,(H,19,24)(H,20,22)(H,21,23)/t17-/m1/s1

InChI Key

LYULOTCFWZMSRP-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD03828776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.327

Distribution Coefficient, logD

0.327

Water Solubility, LogSw

-1.56

Polar Surface Area

81.150

Acid Dissociation Constant (pKa)

11.96

Base Dissociation Constant (pKb)

1.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

C094-2041 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Anti-HIV1 Library (19540 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C094-2041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C094-2041?
Check Price and Availability of C094-2041, 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 C094-2041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C094-2041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C094-2041
  • 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 C094-2041 available by request