D354-0020 Screening compound: butyl 4-[5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-amido]benzoate

D354-0020 Screening compound: butyl 4-[5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-amido]benzoate
D354-0020 Screening compound: butyl 4-[5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D354-0020
butyl 4-[5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-amido]benzoate

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

D354-0020

Molecular Formula

C22H21FN2O4 (C22 H21 FN2 O4)

Compound Name

butyl 4-[5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-amido]benzoate

IUPAC name

butyl 4-[5-(3-fluoro-4-methylphenyl)-12-oxazole-3-amido]benzoate

SMILES

CCCCOC(c(cc1)ccc1NC(c1noc(-c2cc(F)c(C)cc2)c1)=O)=O

InChI

InChI=1S/C22H21FN2O4/c1-3-4-11-28-22(27)15-7-9-17(10-8-15)24-21(26)19-13-20(29-25-19)16-6-5-14(2)18(23)12-16/h5-10,12-13H,3-4,11H2,1-2H3,(H,24,26)

InChI Key

UEEDJSXXNQZCJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08546914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.992

Distribution Coefficient, logD

5.992

Water Solubility, LogSw

-5.41

Polar Surface Area

65.913

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

-5.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with D354-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D354-0020?
Check Price and Availability of D354-0020, 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 D354-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D354-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D354-0020
  • 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 D354-0020 available by request