2043-3466 Screening compound: ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5-dimethylthiophene-3-carboxylate

2043-3466 Screening compound: ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5-dimethylthiophene-3-carboxylate
2043-3466 Screening compound: ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5-dimethylthiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2043-3466
ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5-dimethylthiophene-3-carboxylate

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

2043-3466

Molecular Formula

C19H21Cl2NO4S (C19 H21 Cl2 NO4 S)

Compound Name

ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5-dimethylthiophene-3-carboxylate

IUPAC name

ethyl 2-[4-(24-dichlorophenoxy)butanamido]-45-dimethylthiophene-3-carboxylate

SMILES

CCOC(c1c(NC(CCCOc(ccc(Cl)c2)c2Cl)=O)sc(C)c1C)=O

InChI

InChI=1S/C19H21Cl2NO4S/c1-4-25-19(24)17-11(2)12(3)27-18(17)22-16(23)6-5-9-26-15-8-7-13(20)10-14(15)21/h7-8,10H,4-6,9H2,1-3H3,(H,22,23)

InChI Key

OBMBBVUZRMCXQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01030227

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.870

Distribution Coefficient, logD

2.505

Water Solubility, LogSw

-5.05

Polar Surface Area

51.169

Acid Dissociation Constant (pKa)

5.04

Base Dissociation Constant (pKb)

-3.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

2043-3466 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 2043-3466 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2043-3466?
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What is the minimum amount of 2043-3466 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2043-3466
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2043-3466
  • 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 2043-3466 available by request