V027-7162 Screening compound: N-(4-benzylphenyl)-3-chloro-1-benzothiophene-2-carboxamide

V027-7162 Screening compound: N-(4-benzylphenyl)-3-chloro-1-benzothiophene-2-carboxamide
V027-7162 Screening compound: N-(4-benzylphenyl)-3-chloro-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-7162
N-(4-benzylphenyl)-3-chloro-1-benzothiophene-2-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

V027-7162

Molecular Formula

C22H16ClNOS (C22 H16 ClNOS)

Compound Name

N-(4-benzylphenyl)-3-chloro-1-benzothiophene-2-carboxamide

IUPAC name

N-(4-benzylphenyl)-3-chloro-1-benzothiophene-2-carboxamide

SMILES

O=C(c(sc1c2cccc1)c2Cl)Nc1ccc(Cc2ccccc2)cc1

InChI

InChI=1S/C22H16ClNOS/c23-20-18-8-4-5-9-19(18)26-21(20)22(25)24-17-12-10-16(11-13-17)14-15-6-2-1-3-7-15/h1-13H,14H2,(H,24,25)

InChI Key

IUOSIVDQJGYKCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19943499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.89

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.344

Distribution Coefficient, logD

6.344

Water Solubility, LogSw

-6.28

Polar Surface Area

23.805

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

V027-7162 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with V027-7162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-7162?
Check Price and Availability of V027-7162, 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 V027-7162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-7162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-7162
  • 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 V027-7162 available by request