F180-0179 Screening compound: 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzene-1-sulfonamide

F180-0179 Screening compound: 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzene-1-sulfonamide
F180-0179 Screening compound: 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F180-0179
4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzene-1-sulfonamide

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

F180-0179

Molecular Formula

C19H21N3O5S2 (C19 H21 N3 O5 S2)

Compound Name

4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzene-1-sulfonamide

IUPAC name

4-(35-dimethyl-12-oxazol-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzene-1-sulfonamide

SMILES

Cc1noc(C)c1-c(cc1)ccc1S(NCCc(cc1)ccc1S(N)(=O)=O)(=O)=O

InChI

InChI=1S/C19H21N3O5S2/c1-13-19(14(2)27-22-13)16-5-9-18(10-6-16)29(25,26)21-12-11-15-3-7-17(8-4-15)28(20,23)24/h3-10,21H,11-12H2,1-2H3,(H2,20,23,24)

InChI Key

FPJNNONITWLLNO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27107201

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.52

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.950

Distribution Coefficient, logD

1.950

Water Solubility, LogSw

-2.72

Polar Surface Area

114.208

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

F180-0179 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F180-0179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F180-0179?
Check Price and Availability of F180-0179, 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 F180-0179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F180-0179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F180-0179
  • 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 F180-0179 available by request