C436-2792 Screening compound: 2-{[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-methylanilino}-N~1~-(2-ethoxyphenyl)acetamide

C436-2792 Screening compound: 2-{[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-methylanilino}-N~1~-(2-ethoxyphenyl)acetamide
C436-2792 Screening compound: 2-{[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-methylanilino}-N~1~-(2-ethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C436-2792
2-{[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-methylanilino}-N~1~-(2-ethoxyphenyl)acetamide

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

C436-2792

Molecular Formula

C22H26N4O4S (C22 H26 N4 O4 S)

Compound Name

2-{[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-methylanilino}-N~1~-(2-ethoxyphenyl)acetamide

IUPAC name

n/a

SMILES

CCOc(cccc1)c1NC(CN(c1ccc(C)cc1)S(c1c(C)[nH]nc1C)(=O)=O)=O

InChI

InChI=1S/C22H26N4O4S/c1-5-30-20-9-7-6-8-19(20)23-21(27)14-26(18-12-10-15(2)11-13-18)31(28,29)22-16(3)24-25-17(22)4/h6-13H,5,14H2,1-4H3,(H,23,27)(H,24,25)

InChI Key

HBGNROFWFZIUTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14758006

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.371

Distribution Coefficient, logD

3.371

Water Solubility, LogSw

-3.58

Polar Surface Area

85.369

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C436-2792 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Antifungal Library (16415 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C436-2792 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C436-2792?
Check Price and Availability of C436-2792, 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 C436-2792 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C436-2792
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C436-2792
  • 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 C436-2792 available by request