3281-1001 Screening compound: 1-(4-chlorophenyl)-4-(ethylsulfanyl)phthalazine

3281-1001 Screening compound: 1-(4-chlorophenyl)-4-(ethylsulfanyl)phthalazine
3281-1001 Screening compound: 1-(4-chlorophenyl)-4-(ethylsulfanyl)phthalazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3281-1001
1-(4-chlorophenyl)-4-(ethylsulfanyl)phthalazine

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

3281-1001

Molecular Formula

C16H13ClN2S (C16 H13 ClN2 S)

Compound Name

1-(4-chlorophenyl)-4-(ethylsulfanyl)phthalazine

IUPAC name

1-(4-chlorophenyl)-4-(ethylsulfanyl)phthalazine

SMILES

CCSc1nnc(-c(cc2)ccc2Cl)c2ccccc12

InChI

InChI=1S/C16H13ClN2S/c1-2-20-16-14-6-4-3-5-13(14)15(18-19-16)11-7-9-12(17)10-8-11/h3-10H,2H2,1H3

InChI Key

RDAVMTSRFXQOEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02107729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.81

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.871

Distribution Coefficient, logD

4.871

Water Solubility, LogSw

-5.00

Polar Surface Area

22.340

Acid Dissociation Constant (pKa)

26.50

Base Dissociation Constant (pKb)

1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

3281-1001 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3281-1001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3281-1001?
Check Price and Availability of 3281-1001, 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 3281-1001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3281-1001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3281-1001
  • 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 3281-1001 available by request