C226-0934 Screening compound: 1-[5-(2-methoxyphenyl)-1,2-oxazole-3-carbonyl]-1,2,3,4-tetrahydroquinoline

C226-0934 Screening compound: 1-[5-(2-methoxyphenyl)-1,2-oxazole-3-carbonyl]-1,2,3,4-tetrahydroquinoline
C226-0934 Screening compound: 1-[5-(2-methoxyphenyl)-1,2-oxazole-3-carbonyl]-1,2,3,4-tetrahydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound C226-0934
1-[5-(2-methoxyphenyl)-1,2-oxazole-3-carbonyl]-1,2,3,4-tetrahydroquinoline

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

C226-0934

Molecular Formula

C20H18N2O3 (C20 H18 N2 O3)

Compound Name

1-[5-(2-methoxyphenyl)-1,2-oxazole-3-carbonyl]-1,2,3,4-tetrahydroquinoline

IUPAC name

1-[5-(2-methoxyphenyl)-12-oxazole-3-carbonyl]-1234-tetrahydroquinoline

SMILES

COc(cccc1)c1-c1cc(C(N(CCC2)c3c2cccc3)=O)no1

InChI

InChI=1S/C20H18N2O3/c1-24-18-11-5-3-9-15(18)19-13-16(21-25-19)20(23)22-12-6-8-14-7-2-4-10-17(14)22/h2-5,7,9-11,13H,6,8,12H2,1H3

InChI Key

XMQPFCBZRMVGED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14733004

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.056

Distribution Coefficient, logD

4.056

Water Solubility, LogSw

-4.23

Polar Surface Area

44.717

Acid Dissociation Constant (pKa)

25.58

Base Dissociation Constant (pKb)

-3.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C226-0934 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS targets activity set (6557 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C226-0934 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C226-0934?
Check Price and Availability of C226-0934, 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 C226-0934 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C226-0934
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C226-0934
  • 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 C226-0934 available by request