D473-1595 Screening compound: N~1~-phenyl-3-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

D473-1595 Screening compound: N~1~-phenyl-3-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide
D473-1595 Screening compound: N~1~-phenyl-3-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-1595
N~1~-phenyl-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

D473-1595

Molecular Formula

C16H14N2O4S (C16 H14 N2 O4 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1cccc(N(C(CC2)=O)S2(=O)=O)c1)Nc1ccccc1

InChI

InChI=1S/C16H14N2O4S/c19-15-9-10-23(21,22)18(15)14-8-4-5-12(11-14)16(20)17-13-6-2-1-3-7-13/h1-8,11H,9-10H2,(H,17,20)

InChI Key

NNHYOSZOWMBBAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10089957

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.36

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

1.198

Distribution Coefficient, logD

1.197

Water Solubility, LogSw

-2.46

Polar Surface Area

68.747

Acid Dissociation Constant (pKa)

10.66

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with D473-1595 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-1595?
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What is the minimum amount of D473-1595 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-1595
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-1595
  • 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 D473-1595 available by request