1488-0343 Screening compound: N-{3-cyano-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-4-(diethylsulfamoyl)benzamide

1488-0343 Screening compound: N-{3-cyano-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-4-(diethylsulfamoyl)benzamide
1488-0343 Screening compound: N-{3-cyano-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-4-(diethylsulfamoyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1488-0343
N-{3-cyano-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-4-(diethylsulfamoyl)benzamide

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

1488-0343

Molecular Formula

C19H21N3O3S2 (C19 H21 N3 O3 S2)

Compound Name

N-{3-cyano-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-4-(diethylsulfamoyl)benzamide

IUPAC name

N-{3-cyano-4H5H6H-cyclopenta[b]thiophen-2-yl}-4-(diethylsulfamoyl)benzamide

SMILES

CCN(CC)S(c(cc1)ccc1C(Nc(sc1c2CCC1)c2C#N)=O)(=O)=O

InChI

InChI=1S/C19H21N3O3S2/c1-3-22(4-2)27(24,25)14-10-8-13(9-11-14)18(23)21-19-16(12-20)15-6-5-7-17(15)26-19/h8-11H,3-7H2,1-2H3,(H,21,23)

InChI Key

IUZVGXHWKWAZOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01536897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.191

Distribution Coefficient, logD

0.060

Water Solubility, LogSw

-3.68

Polar Surface Area

71.563

Acid Dissociation Constant (pKa)

4.27

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

1488-0343 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1488-0343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1488-0343?
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What is the minimum amount of 1488-0343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1488-0343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1488-0343
  • 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 1488-0343 available by request