L413-0563 Screening compound: 4-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]benzamide

L413-0563 Screening compound: 4-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]benzamide
L413-0563 Screening compound: 4-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L413-0563
4-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]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

L413-0563

Molecular Formula

C26H26N2O4 (C26 H26 N2 O4)

Compound Name

4-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]benzamide

IUPAC name

4-(1-acetyl-23-dihydro-1H-indol-5-yl)-N-[(24-dimethoxyphenyl)methyl]benzamide

SMILES

CC(N(CC1)c(cc2)c1cc2-c(cc1)ccc1C(NCc(ccc(OC)c1)c1OC)=O)=O

InChI

InChI=1S/C26H26N2O4/c1-17(29)28-13-12-21-14-20(9-11-24(21)28)18-4-6-19(7-5-18)26(30)27-16-22-8-10-23(31-2)15-25(22)32-3/h4-11,14-15H,12-13,16H2,1-3H3,(H,27,30)

InChI Key

CRTMVMQNKPGHPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27251547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.157

Distribution Coefficient, logD

4.157

Water Solubility, LogSw

-4.32

Polar Surface Area

55.973

Acid Dissociation Constant (pKa)

12.78

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

L413-0563 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Bromodomain Modulators Library (5801 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L413-0563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L413-0563?
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What is the minimum amount of L413-0563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L413-0563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L413-0563
  • 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 L413-0563 available by request