K607-0577 Screening compound: 4-cyano-3,5-difluorophenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

K607-0577 Screening compound: 4-cyano-3,5-difluorophenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
K607-0577 Screening compound: 4-cyano-3,5-difluorophenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K607-0577
4-cyano-3,5-difluorophenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

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

K607-0577

Molecular Formula

C18H9ClF2N2O3 (C18 H9 ClF2 N2 O3)

Compound Name

4-cyano-3,5-difluorophenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

IUPAC name

4-cyano-35-difluorophenyl 3-(2-chlorophenyl)-5-methyl-12-oxazole-4-carboxylate

SMILES

Cc1c(C(Oc(cc2F)cc(F)c2C#N)=O)c(-c(cccc2)c2Cl)no1

InChI

InChI=1S/C18H9ClF2N2O3/c1-9-16(17(23-26-9)11-4-2-3-5-13(11)19)18(24)25-10-6-14(20)12(8-22)15(21)7-10/h2-7H,1H3

InChI Key

KBJITZQFQWMRJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03450317

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.73

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.951

Distribution Coefficient, logD

3.951

Water Solubility, LogSw

-4.58

Polar Surface Area

59.633

Acid Dissociation Constant (pKa)

27.12

Base Dissociation Constant (pKb)

-7.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

K607-0577 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antifungal Library (16415 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K607-0577 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K607-0577?
Check Price and Availability of K607-0577, 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 K607-0577 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K607-0577
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K607-0577
  • 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 K607-0577 available by request