F382-0969 Screening compound: 3-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-N-[4-(trifluoromethoxy)phenyl]propanamide

F382-0969 Screening compound: 3-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-N-[4-(trifluoromethoxy)phenyl]propanamide
F382-0969 Screening compound: 3-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-N-[4-(trifluoromethoxy)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F382-0969
3-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-N-[4-(trifluoromethoxy)phenyl]propanamide

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

F382-0969

Molecular Formula

C21H19F3N2O6S (C21 H19 F3 N2 O6 S)

Compound Name

3-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-N-[4-(trifluoromethoxy)phenyl]propanamide

IUPAC name

3-[2-methoxy-5-(3-methyl-12-oxazol-5-yl)benzenesulfonyl]-N-[4-(trifluoromethoxy)phenyl]propanamide

SMILES

Cc1noc(-c(cc2)cc(S(CCC(Nc(cc3)ccc3OC(F)(F)F)=O)(=O)=O)c2OC)c1

InChI

InChI=1S/C21H19F3N2O6S/c1-13-11-18(32-26-13)14-3-8-17(30-2)19(12-14)33(28,29)10-9-20(27)25-15-4-6-16(7-5-15)31-21(22,23)24/h3-8,11-12H,9-10H2,1-2H3,(H,25,27)

InChI Key

YECDSUAYHZUDBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27121738

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.134

Distribution Coefficient, logD

4.134

Water Solubility, LogSw

-4.35

Polar Surface Area

87.061

Acid Dissociation Constant (pKa)

11.44

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

F382-0969 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F382-0969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F382-0969?
Check Price and Availability of F382-0969, 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 F382-0969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F382-0969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F382-0969
  • 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 F382-0969 available by request