C226-0466 Screening compound: 1-[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]-2,6-dimethylpiperidine

C226-0466 Screening compound: 1-[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]-2,6-dimethylpiperidine
C226-0466 Screening compound: 1-[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]-2,6-dimethylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C226-0466
1-[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]-2,6-dimethylpiperidine

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

C226-0466

Molecular Formula

C17H19BrN2O2 (C17 H19 BrN2 O2)

Compound Name

1-[5-(4-bromophenyl)-1,2-oxazole-3-carbonyl]-2,6-dimethylpiperidine

IUPAC name

1-[5-(4-bromophenyl)-12-oxazole-3-carbonyl]-26-dimethylpiperidine

SMILES

CC(CCCC1C)N1C(c1noc(-c(cc2)ccc2Br)c1)=O

InChI

InChI=1S/C17H19BrN2O2/c1-11-4-3-5-12(2)20(11)17(21)15-10-16(22-19-15)13-6-8-14(18)9-7-13/h6-12H,3-5H2,1-2H3

InChI Key

GCLYWSUUDJNWGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09781776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.439

Distribution Coefficient, logD

4.439

Water Solubility, LogSw

-4.33

Polar Surface Area

36.646

Acid Dissociation Constant (pKa)

26.46

Base Dissociation Constant (pKb)

-2.51

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

41.20

C226-0466 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C226-0466 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C226-0466?
Check Price and Availability of C226-0466, 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 C226-0466 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C226-0466
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C226-0466
  • 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 C226-0466 available by request