D473-1666 Screening compound: N~1~-(1,3-thiazol-2-yl)-3-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

D473-1666 Screening compound: N~1~-(1,3-thiazol-2-yl)-3-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide
D473-1666 Screening compound: N~1~-(1,3-thiazol-2-yl)-3-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-1666
N~1~-(1,3-thiazol-2-yl)-3-(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

D473-1666

Molecular Formula

C13H11N3O4S2 (C13 H11 N3 O4 S2)

Compound Name

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

IUPAC name

N-(13-thiazol-2-yl)-3-(113-trioxo-1lambda62-thiazolidin-2-yl)benzamide

SMILES

O=C(c1cccc(N(C(CC2)=O)S2(=O)=O)c1)Nc1nccs1

InChI

InChI=1S/C13H11N3O4S2/c17-11-4-7-22(19,20)16(11)10-3-1-2-9(8-10)12(18)15-13-14-5-6-21-13/h1-3,5-6,8H,4,7H2,(H,14,15,18)

InChI Key

NDKFUTGPKQSBLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10090017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.655

Distribution Coefficient, logD

0.589

Water Solubility, LogSw

-2.35

Polar Surface Area

79.225

Acid Dissociation Constant (pKa)

8.18

Base Dissociation Constant (pKb)

0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

D473-1666 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D473-1666 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-1666?
Check Price and Availability of D473-1666, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D473-1666 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-1666
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-1666
  • 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 D473-1666 available by request