8018-4715 Screening compound: 5-(chloromethyl)-3-(4-methoxyphenyl)-1,2-oxazole

8018-4715 Screening compound: 5-(chloromethyl)-3-(4-methoxyphenyl)-1,2-oxazole
8018-4715 Screening compound: 5-(chloromethyl)-3-(4-methoxyphenyl)-1,2-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-4715
5-(chloromethyl)-3-(4-methoxyphenyl)-1,2-oxazole

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

8018-4715

Molecular Formula

C11H10ClNO2 (C11 H10 ClNO2)

Compound Name

5-(chloromethyl)-3-(4-methoxyphenyl)-1,2-oxazole

IUPAC name

5-(chloromethyl)-3-(4-methoxyphenyl)-12-oxazole

SMILES

COc(cc1)ccc1-c1noc(CCl)c1

InChI

InChI=1S/C11H10ClNO2/c1-14-9-4-2-8(3-5-9)11-6-10(7-12)15-13-11/h2-6H,7H2,1H3

InChI Key

UAVKQZLQYPVICE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01935948

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

223.66

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.411

Distribution Coefficient, logD

3.411

Water Solubility, LogSw

-3.57

Polar Surface Area

28.488

Acid Dissociation Constant (pKa)

26.38

Base Dissociation Constant (pKb)

-4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

8018-4715 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8018-4715 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-4715?
Check Price and Availability of 8018-4715, 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 8018-4715 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-4715
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-4715
  • 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 8018-4715 available by request