L629-0792 Screening compound: 2-{1-[(5-chlorothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

L629-0792 Screening compound: 2-{1-[(5-chlorothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
L629-0792 Screening compound: 2-{1-[(5-chlorothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L629-0792
2-{1-[(5-chlorothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

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

L629-0792

Molecular Formula

C22H26ClN3O4S2 (C22 H26 ClN3 O4 S2)

Compound Name

2-{1-[(5-chlorothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

IUPAC name

2-{1-[(5-chlorothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

SMILES

COc(cc1)cc2c1[nH]cc2CCNC(CC(CC1)CCN1S(c(s1)ccc1Cl)(=O)=O)=O

InChI

InChI=1S/C22H26ClN3O4S2/c1-30-17-2-3-19-18(13-17)16(14-25-19)6-9-24-21(27)12-15-7-10-26(11-8-15)32(28,29)22-5-4-20(23)31-22/h2-5,13-15,25H,6-12H2,1H3,(H,24,27)

InChI Key

GHLCKRYODJFAPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27466501

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.05

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.684

Distribution Coefficient, logD

3.684

Water Solubility, LogSw

-4.27

Polar Surface Area

74.424

Acid Dissociation Constant (pKa)

14.12

Base Dissociation Constant (pKb)

0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

L629-0792 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Indole Derivatives (10091 compounds)

KRAS-Targeted Library (16000 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L629-0792 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L629-0792?
Check Price and Availability of L629-0792, 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 L629-0792 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L629-0792
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L629-0792
  • 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 L629-0792 available by request