4577-0933 Screening compound: 4-{N-[(2-chlorophenyl)methyl]methanesulfonamido}-N-[(pyridin-2-yl)methyl]benzamide

4577-0933 Screening compound: 4-{N-[(2-chlorophenyl)methyl]methanesulfonamido}-N-[(pyridin-2-yl)methyl]benzamide
4577-0933 Screening compound: 4-{N-[(2-chlorophenyl)methyl]methanesulfonamido}-N-[(pyridin-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4577-0933
4-{N-[(2-chlorophenyl)methyl]methanesulfonamido}-N-[(pyridin-2-yl)methyl]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

4577-0933

Molecular Formula

C21H20ClN3O3S (C21 H20 ClN3 O3 S)

Compound Name

4-{N-[(2-chlorophenyl)methyl]methanesulfonamido}-N-[(pyridin-2-yl)methyl]benzamide

IUPAC name

4-{N-[(2-chlorophenyl)methyl]methanesulfonamido}-N-[(pyridin-2-yl)methyl]benzamide

SMILES

CS(N(Cc(cccc1)c1Cl)c(cc1)ccc1C(NCc1ncccc1)=O)(=O)=O

InChI

InChI=1S/C21H20ClN3O3S/c1-29(27,28)25(15-17-6-2-3-8-20(17)22)19-11-9-16(10-12-19)21(26)24-14-18-7-4-5-13-23-18/h2-13H,14-15H2,1H3,(H,24,26)

InChI Key

GCDCUEPRJPDMNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03143527

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.93

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.063

Distribution Coefficient, logD

3.063

Water Solubility, LogSw

-3.55

Polar Surface Area

65.513

Acid Dissociation Constant (pKa)

11.30

Base Dissociation Constant (pKb)

3.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

4577-0933 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 4577-0933 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4577-0933?
Check Price and Availability of 4577-0933, 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 4577-0933 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4577-0933
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4577-0933
  • 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 4577-0933 available by request