C294-0244 Screening compound: N-(3-chlorophenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

C294-0244 Screening compound: N-(3-chlorophenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
C294-0244 Screening compound: N-(3-chlorophenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C294-0244
N-(3-chlorophenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

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

C294-0244

Molecular Formula

C27H24ClN3O3 (C27 H24 ClN3 O3)

Compound Name

N-(3-chlorophenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

IUPAC name

N-(3-chlorophenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-1234-tetrahydroisoquinoline-4-carboxamide

SMILES

COCCN(C(C(C(Nc1cccc(Cl)c1)=O)c1c2cccc1)c1c[nH]c3c1cccc3)C2=O

InChI

InChI=1S/C27H24ClN3O3/c1-34-14-13-31-25(22-16-29-23-12-5-4-9-19(22)23)24(20-10-2-3-11-21(20)27(31)33)26(32)30-18-8-6-7-17(28)15-18/h2-12,15-16,24-25,29H,13-14H2,1H3,(H,30,32)

InChI Key

RXIWHYUOHKUBEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26963794

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.96

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.818

Distribution Coefficient, logD

4.811

Water Solubility, LogSw

-4.81

Polar Surface Area

57.206

Acid Dissociation Constant (pKa)

9.18

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

18.52

C294-0244 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C294-0244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C294-0244?
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What is the minimum amount of C294-0244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C294-0244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C294-0244
  • 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 C294-0244 available by request