D473-0766 Screening compound: N~1~-cyclopentyl-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

D473-0766 Screening compound: N~1~-cyclopentyl-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide
D473-0766 Screening compound: N~1~-cyclopentyl-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-0766
N~1~-cyclopentyl-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)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

D473-0766

Molecular Formula

C15H18N2O4S (C15 H18 N2 O4 S)

Compound Name

N~1~-cyclopentyl-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

IUPAC name

N-cyclopentyl-4-(113-trioxo-1lambda62-thiazolidin-2-yl)benzamide

SMILES

O=C(c(cc1)ccc1N(C(CC1)=O)S1(=O)=O)NC1CCCC1

InChI

InChI=1S/C15H18N2O4S/c18-14-9-10-22(20,21)17(14)13-7-5-11(6-8-13)15(19)16-12-3-1-2-4-12/h5-8,12H,1-4,9-10H2,(H,16,19)

InChI Key

NIJSZFYSLMZDKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12922130

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.840

Distribution Coefficient, logD

0.840

Water Solubility, LogSw

-2.24

Polar Surface Area

70.160

Acid Dissociation Constant (pKa)

14.63

Base Dissociation Constant (pKb)

-0.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

D473-0766 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D473-0766 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-0766?
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What is the minimum amount of D473-0766 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-0766
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-0766
  • 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 D473-0766 available by request