5468-3012 Screening compound: 5-bromo-N-[4-(propan-2-yloxy)phenyl]pyridine-3-carboxamide

5468-3012 Screening compound: 5-bromo-N-[4-(propan-2-yloxy)phenyl]pyridine-3-carboxamide
5468-3012 Screening compound: 5-bromo-N-[4-(propan-2-yloxy)phenyl]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5468-3012
5-bromo-N-[4-(propan-2-yloxy)phenyl]pyridine-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

5468-3012

Molecular Formula

C15H15BrN2O2 (C15 H15 BrN2 O2)

Compound Name

5-bromo-N-[4-(propan-2-yloxy)phenyl]pyridine-3-carboxamide

IUPAC name

5-bromo-N-[4-(propan-2-yloxy)phenyl]pyridine-3-carboxamide

SMILES

CC(C)Oc(cc1)ccc1NC(c1cc(Br)cnc1)=O

InChI

InChI=1S/C15H15BrN2O2/c1-10(2)20-14-5-3-13(4-6-14)18-15(19)11-7-12(16)9-17-8-11/h3-10H,1-2H3,(H,18,19)

InChI Key

DHWXTIVNWKEKEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02959629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.2

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.603

Distribution Coefficient, logD

3.600

Water Solubility, LogSw

-3.66

Polar Surface Area

39.740

Acid Dissociation Constant (pKa)

9.65

Base Dissociation Constant (pKb)

0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

5468-3012 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 5468-3012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5468-3012?
Check Price and Availability of 5468-3012, 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 5468-3012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5468-3012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5468-3012
  • 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 5468-3012 available by request