V028-6900 Screening compound: 2-[4-(2-chlorobenzamido)piperidin-1-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide

V028-6900 Screening compound: 2-[4-(2-chlorobenzamido)piperidin-1-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide
V028-6900 Screening compound: 2-[4-(2-chlorobenzamido)piperidin-1-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6900
2-[4-(2-chlorobenzamido)piperidin-1-yl]-N-[2-(thiophen-2-yl)ethyl]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

V028-6900

Molecular Formula

C25H26ClN3O2S (C25 H26 ClN3 O2 S)

Compound Name

2-[4-(2-chlorobenzamido)piperidin-1-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide

IUPAC name

2-[4-(2-chlorobenzamido)piperidin-1-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide

SMILES

O=C(c(cccc1)c1N(CC1)CCC1NC(c(cccc1)c1Cl)=O)NCCc1cccs1

InChI

InChI=1S/C25H26ClN3O2S/c26-22-9-3-1-7-20(22)25(31)28-18-12-15-29(16-13-18)23-10-4-2-8-21(23)24(30)27-14-11-19-6-5-17-32-19/h1-10,17-18H,11-16H2,(H,27,30)(H,28,31)

InChI Key

HRMJEFWPDURNTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19893918

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

468.02

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.935

Distribution Coefficient, logD

4.935

Water Solubility, LogSw

-4.89

Polar Surface Area

52.610

Acid Dissociation Constant (pKa)

12.92

Base Dissociation Constant (pKb)

3.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

V028-6900 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-6900 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6900?
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What is the minimum amount of V028-6900 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6900
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6900
  • 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 V028-6900 available by request