8006-2720 Screening compound: 4-chloro-3-(morpholine-4-sulfonyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide

8006-2720 Screening compound: 4-chloro-3-(morpholine-4-sulfonyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide
8006-2720 Screening compound: 4-chloro-3-(morpholine-4-sulfonyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-2720
4-chloro-3-(morpholine-4-sulfonyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide

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

8006-2720

Molecular Formula

C19H17ClN4O4S2 (C19 H17 ClN4 O4 S2)

Compound Name

4-chloro-3-(morpholine-4-sulfonyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide

IUPAC name

4-chloro-3-(morpholine-4-sulfonyl)-N-(5-phenyl-134-thiadiazol-2-yl)benzamide

SMILES

O=C(c(cc1)cc(S(N2CCOCC2)(=O)=O)c1Cl)Nc1nnc(-c2ccccc2)s1

InChI

InChI=1S/C19H17ClN4O4S2/c20-15-7-6-14(12-16(15)30(26,27)24-8-10-28-11-9-24)17(25)21-19-23-22-18(29-19)13-4-2-1-3-5-13/h1-7,12H,8-11H2,(H,21,23,25)

InChI Key

WHHLONRJSZVFHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00824453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.95

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.289

Distribution Coefficient, logD

3.117

Water Solubility, LogSw

-3.73

Polar Surface Area

86.223

Acid Dissociation Constant (pKa)

7.71

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

8006-2720 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8006-2720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-2720?
Check Price and Availability of 8006-2720, 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 8006-2720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-2720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-2720
  • 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 8006-2720 available by request