0606-6002 Screening compound: 2-[(2-methylpropoxy)carbonyl]phenyl pyridine-4-carboxylate

0606-6002 Screening compound: 2-[(2-methylpropoxy)carbonyl]phenyl pyridine-4-carboxylate
0606-6002 Screening compound: 2-[(2-methylpropoxy)carbonyl]phenyl pyridine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0606-6002
2-[(2-methylpropoxy)carbonyl]phenyl pyridine-4-carboxylate

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

0606-6002

Molecular Formula

C17H17NO4 (C17 H17 NO4)

Compound Name

2-[(2-methylpropoxy)carbonyl]phenyl pyridine-4-carboxylate

IUPAC name

2-[(2-methylpropoxy)carbonyl]phenyl pyridine-4-carboxylate

SMILES

CC(C)COC(c(cccc1)c1OC(c1ccncc1)=O)=O

InChI

InChI=1S/C17H17NO4/c1-12(2)11-21-17(20)14-5-3-4-6-15(14)22-16(19)13-7-9-18-10-8-13/h3-10,12H,11H2,1-2H3

InChI Key

GOPARTHBFWEFIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00805696

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.208

Distribution Coefficient, logD

3.208

Water Solubility, LogSw

-3.56

Polar Surface Area

51.260

Acid Dissociation Constant (pKa)

25.44

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

0606-6002 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Angiogenesis library (14822 compounds)

Antiviral Annotated Library (21441 compounds)

Antiviral Library (67538 compounds)

Frequent Hitters Library (7624 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
  • Pool
Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 0606-6002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0606-6002?
Check Price and Availability of 0606-6002, 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 0606-6002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0606-6002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0606-6002
  • 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 0606-6002 available by request