1683-0592 Screening compound: 2,4-diethyl 3-methyl-5-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}thiophene-2,4-dicarboxylate

1683-0592 Screening compound: 2,4-diethyl 3-methyl-5-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}thiophene-2,4-dicarboxylate
1683-0592 Screening compound: 2,4-diethyl 3-methyl-5-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}thiophene-2,4-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-0592
2,4-diethyl 3-methyl-5-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}thiophene-2,4-dicarboxylate

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

1683-0592

Molecular Formula

C23H29NO6S (C23 H29 NO6 S)

Compound Name

2,4-diethyl 3-methyl-5-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}thiophene-2,4-dicarboxylate

IUPAC name

24-diethyl 3-methyl-5-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}thiophene-24-dicarboxylate

SMILES

CCOC(c1c(NC(COc2c(C(C)C)ccc(C)c2)=O)sc(C(OCC)=O)c1C)=O

InChI

InChI=1S/C23H29NO6S/c1-7-28-22(26)19-15(6)20(23(27)29-8-2)31-21(19)24-18(25)12-30-17-11-14(5)9-10-16(17)13(3)4/h9-11,13H,7-8,12H2,1-6H3,(H,24,25)

InChI Key

LAOSSFUXEWRMHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00706726

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.397

Distribution Coefficient, logD

3.392

Water Solubility, LogSw

-5.40

Polar Surface Area

72.004

Acid Dissociation Constant (pKa)

5.40

Base Dissociation Constant (pKb)

-8.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

1683-0592 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1683-0592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-0592?
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What is the minimum amount of 1683-0592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-0592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-0592
  • 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 1683-0592 available by request