F176-0494 Screening compound: N-(2,5-dimethoxyphenyl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide

F176-0494 Screening compound: N-(2,5-dimethoxyphenyl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide
F176-0494 Screening compound: N-(2,5-dimethoxyphenyl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F176-0494
N-(2,5-dimethoxyphenyl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-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

F176-0494

Molecular Formula

C20H22N2O5S (C20 H22 N2 O5 S)

Compound Name

N-(2,5-dimethoxyphenyl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide

IUPAC name

N-(25-dimethoxyphenyl)-5-(35-dimethyl-12-oxazol-4-yl)-2-methylbenzene-1-sulfonamide

SMILES

Cc1noc(C)c1-c1cc(S(Nc(cc(cc2)OC)c2OC)(=O)=O)c(C)cc1

InChI

InChI=1S/C20H22N2O5S/c1-12-6-7-15(20-13(2)21-27-14(20)3)10-19(12)28(23,24)22-17-11-16(25-4)8-9-18(17)26-5/h6-11,22H,1-5H3

InChI Key

GHWWKETZXMWTAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27106976

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.620

Distribution Coefficient, logD

1.288

Water Solubility, LogSw

-4.13

Polar Surface Area

77.131

Acid Dissociation Constant (pKa)

5.07

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F176-0494 in Drug Discovery

Included in Screening Libraries

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

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F176-0494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F176-0494?
Check Price and Availability of F176-0494, 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 F176-0494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F176-0494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F176-0494
  • 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 F176-0494 available by request