C565-0180 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamide

C565-0180 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamide
C565-0180 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C565-0180
N-(5-chloro-2-methoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamide

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

C565-0180

Molecular Formula

C24H22ClN3O5S (C24 H22 ClN3 O5 S)

Compound Name

N-(5-chloro-2-methoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-2-(2-oxo-1234-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamide

SMILES

COc(ccc(Cl)c1)c1NC(C(c1ccccc1)NS(c(cc1)cc(CC2)c1NC2=O)(=O)=O)=O

InChI

InChI=1S/C24H22ClN3O5S/c1-33-21-11-8-17(25)14-20(21)27-24(30)23(15-5-3-2-4-6-15)28-34(31,32)18-9-10-19-16(13-18)7-12-22(29)26-19/h2-6,8-11,13-14,23,28H,7,12H2,1H3,(H,26,29)(H,27,30)/t23-/m1/s1

InChI Key

UETRYHAEEJVFBJ-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD14772370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.97

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.438

Distribution Coefficient, logD

3.299

Water Solubility, LogSw

-3.72

Polar Surface Area

96.407

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

C565-0180 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

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

CORONAVIRUS Library (20774 compounds)

SH2 Library (10483 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C565-0180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C565-0180?
Check Price and Availability of C565-0180, 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 C565-0180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C565-0180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C565-0180
  • 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 C565-0180 available by request