C444-0932 Screening compound: N-(2-methylphenyl)-3-[(1-propanoyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]propanamide

C444-0932 Screening compound: N-(2-methylphenyl)-3-[(1-propanoyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]propanamide
C444-0932 Screening compound: N-(2-methylphenyl)-3-[(1-propanoyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C444-0932
N-(2-methylphenyl)-3-[(1-propanoyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]propanamide

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

C444-0932

Molecular Formula

C22H26N2O4S (C22 H26 N2 O4 S)

Compound Name

N-(2-methylphenyl)-3-[(1-propanoyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]propanamide

IUPAC name

n/a

SMILES

CCC(N(CCC1)c(cc2)c1cc2S(CCC(Nc1c(C)cccc1)=O)(=O)=O)=O

InChI

InChI=1S/C22H26N2O4S/c1-3-22(26)24-13-6-8-17-15-18(10-11-20(17)24)29(27,28)14-12-21(25)23-19-9-5-4-7-16(19)2/h4-5,7,9-11,15H,3,6,8,12-14H2,1-2H3,(H,23,25)

InChI Key

WSEXTKONAHUXKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14758229

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.260

Distribution Coefficient, logD

2.260

Water Solubility, LogSw

-2.84

Polar Surface Area

66.512

Acid Dissociation Constant (pKa)

11.53

Base Dissociation Constant (pKb)

-1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

C444-0932 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C444-0932 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C444-0932?
Check Price and Availability of C444-0932, 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 C444-0932 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C444-0932
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C444-0932
  • 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 C444-0932 available by request