Z606-3812 Screening compound: N~3~-(4-fluoro-2-methylphenyl)-5-isopropyl-3-isoxazolecarboxamide

Z606-3812 Screening compound: N~3~-(4-fluoro-2-methylphenyl)-5-isopropyl-3-isoxazolecarboxamide
Z606-3812 Screening compound: N~3~-(4-fluoro-2-methylphenyl)-5-isopropyl-3-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Z606-3812
N~3~-(4-fluoro-2-methylphenyl)-5-isopropyl-3-isoxazolecarboxamide

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

Z606-3812

Molecular Formula

C14H15FN2O2 (C14 H15 FN2 O2)

Compound Name

N~3~-(4-fluoro-2-methylphenyl)-5-isopropyl-3-isoxazolecarboxamide

IUPAC name

N-(4-fluoro-2-methylphenyl)-5-(propan-2-yl)-12-oxazole-3-carboxamide

SMILES

CC(C)c1cc(C(Nc(cc2)c(C)cc2F)=O)no1

InChI

InChI=1S/C14H15FN2O2/c1-8(2)13-7-12(17-19-13)14(18)16-11-5-4-10(15)6-9(11)3/h4-8H,1-3H3,(H,16,18)

InChI Key

ZTYXPFHHFZYFOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27640595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.466

Distribution Coefficient, logD

3.465

Water Solubility, LogSw

-3.66

Polar Surface Area

44.439

Acid Dissociation Constant (pKa)

10.12

Base Dissociation Constant (pKb)

-2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.57

Z606-3812 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with Z606-3812 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z606-3812?
Check Price and Availability of Z606-3812, 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 Z606-3812 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z606-3812
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z606-3812
  • 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 Z606-3812 available by request