1683-0657 Screening compound: ethyl 2-[6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

1683-0657 Screening compound: ethyl 2-[6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate
1683-0657 Screening compound: ethyl 2-[6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-0657
ethyl 2-[6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamido]-4H,5H,6H-cyclopenta[b]thiophene-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

1683-0657

Molecular Formula

C24H26N2O5S (C24 H26 N2 O5 S)

Compound Name

ethyl 2-[6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

IUPAC name

ethyl 2-[6-(13-dioxo-23-dihydro-1H-isoindol-2-yl)hexanamido]-4H5H6H-cyclopenta[b]thiophene-3-carboxylate

SMILES

CCOC(c1c(NC(CCCCCN(C(c2c3cccc2)=O)C3=O)=O)sc2c1CCC2)=O

InChI

InChI=1S/C24H26N2O5S/c1-2-31-24(30)20-17-11-8-12-18(17)32-21(20)25-19(27)13-4-3-7-14-26-22(28)15-9-5-6-10-16(15)23(26)29/h5-6,9-10H,2-4,7-8,11-14H2,1H3,(H,25,27)

InChI Key

DJMRMTZUAXMUQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00706789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.704

Distribution Coefficient, logD

1.360

Water Solubility, LogSw

-4.07

Polar Surface Area

73.454

Acid Dissociation Constant (pKa)

5.06

Base Dissociation Constant (pKb)

-4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with 1683-0657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-0657?
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What is the minimum amount of 1683-0657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-0657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-0657
  • 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 1683-0657 available by request