C301-5423 Screening compound: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)-2,3-dihydro-1H-indene-1,3-dione

C301-5423 Screening compound: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)-2,3-dihydro-1H-indene-1,3-dione
C301-5423 Screening compound: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)-2,3-dihydro-1H-indene-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-5423
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)-2,3-dihydro-1H-indene-1,3-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

C301-5423

Molecular Formula

C28H28N2O3 (C28 H28 N2 O3)

Compound Name

2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)-2,3-dihydro-1H-indene-1,3-dione

IUPAC name

2-[4-(23-dimethylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)-23-dihydro-1H-indene-13-dione

SMILES

Cc1cccc(N(CC2)CCN2C(C(c2c3cccc2)=O)(C3=O)c(cc2)ccc2OC)c1C

InChI

InChI=1S/C28H28N2O3/c1-19-7-6-10-25(20(19)2)29-15-17-30(18-16-29)28(21-11-13-22(33-3)14-12-21)26(31)23-8-4-5-9-24(23)27(28)32/h4-14H,15-18H2,1-3H3

InChI Key

BTARDGRZSMPISR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743984

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.165

Distribution Coefficient, logD

6.165

Water Solubility, LogSw

-5.67

Polar Surface Area

39.057

Acid Dissociation Constant (pKa)

24.33

Base Dissociation Constant (pKb)

3.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

C301-5423 in Drug Discovery

Included in Screening Libraries

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C301-5423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-5423?
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What is the minimum amount of C301-5423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-5423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-5423
  • 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 C301-5423 available by request