0074-0074 Screening compound: 4-propylphenyl 2-chloro-4-hydroxybenzoate

0074-0074 Screening compound: 4-propylphenyl 2-chloro-4-hydroxybenzoate
0074-0074 Screening compound: 4-propylphenyl 2-chloro-4-hydroxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0074-0074
4-propylphenyl 2-chloro-4-hydroxybenzoate

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

0074-0074

Molecular Formula

C16H15ClO3 (C16 H15 ClO3)

Compound Name

4-propylphenyl 2-chloro-4-hydroxybenzoate

IUPAC name

4-propylphenyl 2-chloro-4-hydroxybenzoate

SMILES

CCCc(cc1)ccc1OC(c(ccc(O)c1)c1Cl)=O

InChI

InChI=1S/C16H15ClO3/c1-2-3-11-4-7-13(8-5-11)20-16(19)14-9-6-12(18)10-15(14)17/h4-10,18H,2-3H2,1H3

InChI Key

KLRCTKSAAPBESE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00600488

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.75

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.086

Distribution Coefficient, logD

4.911

Water Solubility, LogSw

-5.03

Polar Surface Area

38.233

Acid Dissociation Constant (pKa)

7.70

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

0074-0074 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Cardiovascular Library (22201 compounds)

Human Receptors Annotated Library (5376 compounds)

Carbonic Anhydrase II Library (4939 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0074-0074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0074-0074?
Check Price and Availability of 0074-0074, 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 0074-0074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0074-0074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0074-0074
  • 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 0074-0074 available by request