F176-0530 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide

F176-0530 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide
F176-0530 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F176-0530
N-(2H-1,3-benzodioxol-5-yl)-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

F176-0530

Molecular Formula

C19H18N2O5S (C19 H18 N2 O5 S)

Compound Name

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

IUPAC name

N-(2H-13-benzodioxol-5-yl)-5-(35-dimethyl-12-oxazol-4-yl)-2-methylbenzene-1-sulfonamide

SMILES

Cc1noc(C)c1-c1cc(S(Nc(cc2)cc3c2OCO3)(=O)=O)c(C)cc1

InChI

InChI=1S/C19H18N2O5S/c1-11-4-5-14(19-12(2)20-26-13(19)3)8-18(11)27(22,23)21-15-6-7-16-17(9-15)25-10-24-16/h4-9,21H,10H2,1-3H3

InChI Key

VIXSUTVOEOFOBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27106993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.598

Distribution Coefficient, logD

2.364

Water Solubility, LogSw

-4.04

Polar Surface Area

79.770

Acid Dissociation Constant (pKa)

6.19

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

F176-0530 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F176-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F176-0530?
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What is the minimum amount of F176-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F176-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F176-0530
  • 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 F176-0530 available by request