G025-0224 Screening compound: 2-(3-{[4-(2-pyrimidinyl)piperazino]carbonyl}phenyl)tetrahydro-1H-1lambda~6~-isothiazole-1,1-dione

G025-0224 Screening compound: 2-(3-{[4-(2-pyrimidinyl)piperazino]carbonyl}phenyl)tetrahydro-1H-1lambda~6~-isothiazole-1,1-dione
G025-0224 Screening compound: 2-(3-{[4-(2-pyrimidinyl)piperazino]carbonyl}phenyl)tetrahydro-1H-1lambda~6~-isothiazole-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound G025-0224
2-(3-{[4-(2-pyrimidinyl)piperazino]carbonyl}phenyl)tetrahydro-1H-1lambda~6~-isothiazole-1,1-dione

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

G025-0224

Molecular Formula

C18H21N5O3S (C18 H21 N5 O3 S)

Compound Name

2-(3-{[4-(2-pyrimidinyl)piperazino]carbonyl}phenyl)tetrahydro-1H-1lambda~6~-isothiazole-1,1-dione

IUPAC name

2-{3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-1lambda62-thiazolidine-11-dione

SMILES

O=C(c1cccc(N(CCC2)S2(=O)=O)c1)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C18H21N5O3S/c24-17(21-9-11-22(12-10-21)18-19-6-2-7-20-18)15-4-1-5-16(14-15)23-8-3-13-27(23,25)26/h1-2,4-7,14H,3,8-13H2

InChI Key

OQNMSCOVWRYVAW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08141059

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.874

Distribution Coefficient, logD

0.874

Water Solubility, LogSw

-2.07

Polar Surface Area

70.545

Acid Dissociation Constant (pKa)

21.00

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.89

References: we are preparing a list of scientific research reports with G025-0224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G025-0224?
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What is the minimum amount of G025-0224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G025-0224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G025-0224
  • 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 G025-0224 available by request