K607-0587 Screening compound: 4-formylphenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

K607-0587 Screening compound: 4-formylphenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
K607-0587 Screening compound: 4-formylphenyl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K607-0587
4-formylphenyl 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

K607-0587

Molecular Formula

C18H12ClNO4 (C18 H12 ClNO4)

Compound Name

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

IUPAC name

4-formylphenyl 3-(2-chlorophenyl)-5-methyl-12-oxazole-4-carboxylate

SMILES

Cc1c(C(Oc2ccc(C=O)cc2)=O)c(-c(cccc2)c2Cl)no1

InChI

InChI=1S/C18H12ClNO4/c1-11-16(17(20-24-11)14-4-2-3-5-15(14)19)18(22)23-13-8-6-12(10-21)7-9-13/h2-10H,1H3

InChI Key

XDUMKAVWFFPBRN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02614980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.75

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.461

Distribution Coefficient, logD

3.461

Water Solubility, LogSw

-4.25

Polar Surface Area

56.736

Acid Dissociation Constant (pKa)

27.12

Base Dissociation Constant (pKb)

-7.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

K607-0587 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with K607-0587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K607-0587?
Check Price and Availability of K607-0587, 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 K607-0587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K607-0587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K607-0587
  • 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 K607-0587 available by request