D473-1192 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-4-(4,4-dimethyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

D473-1192 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-4-(4,4-dimethyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide
D473-1192 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-4-(4,4-dimethyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-1192
N~1~-(3-chloro-4-fluorophenyl)-4-(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

D473-1192

Molecular Formula

C18H16ClFN2O4S (C18 H16 ClFN2 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(CS(N1c(cc2)ccc2C(Nc(cc2)cc(Cl)c2F)=O)(=O)=O)C1=O

InChI

InChI=1S/C18H16ClFN2O4S/c1-18(2)10-27(25,26)22(17(18)24)13-6-3-11(4-7-13)16(23)21-12-5-8-15(20)14(19)9-12/h3-9H,10H2,1-2H3,(H,21,23)

InChI Key

MOTAIBMFHWILKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10089630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.85

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

3.344

Distribution Coefficient, logD

3.009

Water Solubility, LogSw

-3.85

Polar Surface Area

68.469

Acid Dissociation Constant (pKa)

7.33

Base Dissociation Constant (pKb)

-3.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

D473-1192 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with D473-1192 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-1192?
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What is the minimum amount of D473-1192 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-1192
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-1192
  • 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 D473-1192 available by request