8009-3980 Screening compound: 4-bromo-3-(diethylsulfamoyl)-N-(1,3,4-thiadiazol-2-yl)benzamide

8009-3980 Screening compound: 4-bromo-3-(diethylsulfamoyl)-N-(1,3,4-thiadiazol-2-yl)benzamide
8009-3980 Screening compound: 4-bromo-3-(diethylsulfamoyl)-N-(1,3,4-thiadiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-3980
4-bromo-3-(diethylsulfamoyl)-N-(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

8009-3980

Molecular Formula

C13H15BrN4O3S2 (C13 H15 BrN4 O3 S2)

Compound Name

4-bromo-3-(diethylsulfamoyl)-N-(1,3,4-thiadiazol-2-yl)benzamide

IUPAC name

4-bromo-3-(diethylsulfamoyl)-N-(134-thiadiazol-2-yl)benzamide

SMILES

CCN(CC)S(c(cc(cc1)C(Nc2nncs2)=O)c1Br)(=O)=O

InChI

InChI=1S/C13H15BrN4O3S2/c1-3-18(4-2)23(20,21)11-7-9(5-6-10(11)14)12(19)16-13-17-15-8-22-13/h5-8H,3-4H2,1-2H3,(H,16,17,19)

InChI Key

XGKHYQWUOUMURI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01197405

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.32

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.308

Distribution Coefficient, logD

1.087

Water Solubility, LogSw

-3.01

Polar Surface Area

78.002

Acid Dissociation Constant (pKa)

6.21

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

8009-3980 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro
Therapeutical areas:
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8009-3980 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-3980?
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What is the minimum amount of 8009-3980 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-3980
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-3980
  • 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 8009-3980 available by request