C226-1056 Screening compound: 5-(3,4-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1,2-oxazole-3-carboxamide

C226-1056 Screening compound: 5-(3,4-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1,2-oxazole-3-carboxamide
C226-1056 Screening compound: 5-(3,4-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C226-1056
5-(3,4-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1,2-oxazole-3-carboxamide

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

C226-1056

Molecular Formula

C18H23N3O5 (C18 H23 N3 O5)

Compound Name

5-(3,4-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1,2-oxazole-3-carboxamide

IUPAC name

5-(34-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-12-oxazole-3-carboxamide

SMILES

COc(ccc(-c1cc(C(NCCN2CCOCC2)=O)no1)c1)c1OC

InChI

InChI=1S/C18H23N3O5/c1-23-15-4-3-13(11-17(15)24-2)16-12-14(20-26-16)18(22)19-5-6-21-7-9-25-10-8-21/h3-4,11-12H,5-10H2,1-2H3,(H,19,22)

InChI Key

CVGWINRAEGZCQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09782178

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.177

Distribution Coefficient, logD

1.147

Water Solubility, LogSw

-2.09

Polar Surface Area

73.180

Acid Dissociation Constant (pKa)

13.82

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

C226-1056 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Angiogenesis library (14822 compounds)

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with C226-1056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C226-1056?
Check Price and Availability of C226-1056, 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 C226-1056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C226-1056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C226-1056
  • 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 C226-1056 available by request