L413-0516 Screening compound: 1-{5-[4-(piperidinocarbonyl)phenyl]-2,3-dihydro-1H-indol-1-yl}-1-ethanone

L413-0516 Screening compound: 1-{5-[4-(piperidinocarbonyl)phenyl]-2,3-dihydro-1H-indol-1-yl}-1-ethanone
L413-0516 Screening compound: 1-{5-[4-(piperidinocarbonyl)phenyl]-2,3-dihydro-1H-indol-1-yl}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound L413-0516
1-{5-[4-(piperidinocarbonyl)phenyl]-2,3-dihydro-1H-indol-1-yl}-1-ethanone

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

L413-0516

Molecular Formula

C22H24N2O2 (C22 H24 N2 O2)

Compound Name

1-{5-[4-(piperidinocarbonyl)phenyl]-2,3-dihydro-1H-indol-1-yl}-1-ethanone

IUPAC name

1-{5-[4-(piperidine-1-carbonyl)phenyl]-23-dihydro-1H-indol-1-yl}ethan-1-one

SMILES

CC(N(CC1)c(cc2)c1cc2-c(cc1)ccc1C(N1CCCCC1)=O)=O

InChI

InChI=1S/C22H24N2O2/c1-16(25)24-14-11-20-15-19(9-10-21(20)24)17-5-7-18(8-6-17)22(26)23-12-3-2-4-13-23/h5-10,15H,2-4,11-14H2,1H3

InChI Key

QHTLRZBAOITRDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27251524

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.353

Distribution Coefficient, logD

3.353

Water Solubility, LogSw

-3.57

Polar Surface Area

33.033

Acid Dissociation Constant (pKa)

22.79

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.36

L413-0516 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Bromodomain Modulators Library (5801 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L413-0516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L413-0516?
Check Price and Availability of L413-0516, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L413-0516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L413-0516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L413-0516
  • 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 L413-0516 available by request