8007-0395 Screening compound: 4-(4-bromophenyl)-2-phenyl-1(2H)-phthalazinethione

8007-0395 Screening compound: 4-(4-bromophenyl)-2-phenyl-1(2H)-phthalazinethione
8007-0395 Screening compound: 4-(4-bromophenyl)-2-phenyl-1(2H)-phthalazinethione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-0395
4-(4-bromophenyl)-2-phenyl-1(2H)-phthalazinethione

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

8007-0395

Molecular Formula

C20H13BrN2S (C20 H13 BrN2 S)

Compound Name

4-(4-bromophenyl)-2-phenyl-1(2H)-phthalazinethione

IUPAC name

4-(4-bromophenyl)-2-phenyl-12-dihydrophthalazine-1-thione

SMILES

S=C1N(c2ccccc2)N=C(c(cc2)ccc2Br)c2c1cccc2

InChI

InChI=1S/C20H13BrN2S/c21-15-12-10-14(11-13-15)19-17-8-4-5-9-18(17)20(24)23(22-19)16-6-2-1-3-7-16/h1-13H

InChI Key

IFYNKZAFRZSIJR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00754927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.780

Distribution Coefficient, logD

5.780

Water Solubility, LogSw

-6.29

Polar Surface Area

12.549

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8007-0395 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Human GPCR Annotated Library (5539 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8007-0395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-0395?
Check Price and Availability of 8007-0395, 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 8007-0395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-0395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-0395
  • 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 8007-0395 available by request