3297-0526 Screening compound: 2-methylpropyl 4-[2-(2-methylphenoxy)acetamido]benzoate

3297-0526 Screening compound: 2-methylpropyl 4-[2-(2-methylphenoxy)acetamido]benzoate
3297-0526 Screening compound: 2-methylpropyl 4-[2-(2-methylphenoxy)acetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3297-0526
2-methylpropyl 4-[2-(2-methylphenoxy)acetamido]benzoate

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

3297-0526

Molecular Formula

C20H23NO4 (C20 H23 NO4)

Compound Name

2-methylpropyl 4-[2-(2-methylphenoxy)acetamido]benzoate

IUPAC name

2-methylpropyl 4-[2-(2-methylphenoxy)acetamido]benzoate

SMILES

CC(C)COC(c(cc1)ccc1NC(COc1c(C)cccc1)=O)=O

InChI

InChI=1S/C20H23NO4/c1-14(2)12-25-20(23)16-8-10-17(11-9-16)21-19(22)13-24-18-7-5-4-6-15(18)3/h4-11,14H,12-13H2,1-3H3,(H,21,22)

InChI Key

VWTRNGRWPCNWKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01184802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.885

Distribution Coefficient, logD

4.885

Water Solubility, LogSw

-4.76

Polar Surface Area

51.831

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

-1.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

3297-0526 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 3297-0526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3297-0526?
Check Price and Availability of 3297-0526, 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 3297-0526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3297-0526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3297-0526
  • 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 3297-0526 available by request