D473-1742 Screening compound: 2-(3-{[4-(2-methoxyphenyl)piperazino]carbonyl}phenyl)-4,4-dimethyldihydro-1H-1lambda~6~-isothiazole-1,1,3(2H)-trione

D473-1742 Screening compound: 2-(3-{[4-(2-methoxyphenyl)piperazino]carbonyl}phenyl)-4,4-dimethyldihydro-1H-1lambda~6~-isothiazole-1,1,3(2H)-trione
D473-1742 Screening compound: 2-(3-{[4-(2-methoxyphenyl)piperazino]carbonyl}phenyl)-4,4-dimethyldihydro-1H-1lambda~6~-isothiazole-1,1,3(2H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-1742
2-(3-{[4-(2-methoxyphenyl)piperazino]carbonyl}phenyl)-4,4-dimethyldihydro-1H-1lambda~6~-isothiazole-1,1,3(2H)-trione

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

D473-1742

Molecular Formula

C23H27N3O5S (C23 H27 N3 O5 S)

Compound Name

2-(3-{[4-(2-methoxyphenyl)piperazino]carbonyl}phenyl)-4,4-dimethyldihydro-1H-1lambda~6~-isothiazole-1,1,3(2H)-trione

IUPAC name

2-{3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}-44-dimethyl-1lambda62-thiazolidine-113-trione

SMILES

CC(C)(CS(N1c2cc(C(N(CC3)CCN3c(cccc3)c3OC)=O)ccc2)(=O)=O)C1=O

InChI

InChI=1S/C23H27N3O5S/c1-23(2)16-32(29,30)26(22(23)28)18-8-6-7-17(15-18)21(27)25-13-11-24(12-14-25)19-9-4-5-10-20(19)31-3/h4-10,15H,11-14,16H2,1-3H3

InChI Key

ULHBHGFCAATIPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10090074

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.339

Distribution Coefficient, logD

2.339

Water Solubility, LogSw

-2.66

Polar Surface Area

72.616

Acid Dissociation Constant (pKa)

22.10

Base Dissociation Constant (pKb)

5.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with D473-1742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-1742?
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What is the minimum amount of D473-1742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-1742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-1742
  • 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 D473-1742 available by request