D473-1790 Screening compound: N~1~-(3-chloro-4-methylphenyl)-3-(4,4-dimethyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

D473-1790 Screening compound: N~1~-(3-chloro-4-methylphenyl)-3-(4,4-dimethyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide
D473-1790 Screening compound: N~1~-(3-chloro-4-methylphenyl)-3-(4,4-dimethyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-1790
N~1~-(3-chloro-4-methylphenyl)-3-(4,4-dimethyl-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

D473-1790

Molecular Formula

C19H19ClN2O4S (C19 H19 ClN2 O4 S)

Compound Name

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

IUPAC name

N-(3-chloro-4-methylphenyl)-3-(44-dimethyl-113-trioxo-1lambda62-thiazolidin-2-yl)benzamide

SMILES

CC(C)(CS(N1c2cccc(C(Nc3cc(Cl)c(C)cc3)=O)c2)(=O)=O)C1=O

InChI

InChI=1S/C19H19ClN2O4S/c1-12-7-8-14(10-16(12)20)21-17(23)13-5-4-6-15(9-13)22-18(24)19(2,3)11-27(22,25)26/h4-10H,11H2,1-3H3,(H,21,23)

InChI Key

QTUKBCIDMGOWHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10090118

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.89

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

4.097

Distribution Coefficient, logD

4.073

Water Solubility, LogSw

-4.42

Polar Surface Area

68.469

Acid Dissociation Constant (pKa)

8.66

Base Dissociation Constant (pKb)

-1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with D473-1790 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-1790?
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What is the minimum amount of D473-1790 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-1790
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-1790
  • 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 D473-1790 available by request