7888-0679 Screening compound: 4-butoxy-N-(5-chloro-2,1,3-benzothiadiazol-4-yl)benzamide

7888-0679 Screening compound: 4-butoxy-N-(5-chloro-2,1,3-benzothiadiazol-4-yl)benzamide
7888-0679 Screening compound: 4-butoxy-N-(5-chloro-2,1,3-benzothiadiazol-4-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7888-0679
4-butoxy-N-(5-chloro-2,1,3-benzothiadiazol-4-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

7888-0679

Molecular Formula

C17H16ClN3O2S (C17 H16 ClN3 O2 S)

Compound Name

4-butoxy-N-(5-chloro-2,1,3-benzothiadiazol-4-yl)benzamide

IUPAC name

4-butoxy-N-(5-chloro-213-benzothiadiazol-4-yl)benzamide

SMILES

CCCCOc(cc1)ccc1C(Nc(c1nsnc1cc1)c1Cl)=O

InChI

InChI=1S/C17H16ClN3O2S/c1-2-3-10-23-12-6-4-11(5-7-12)17(22)19-15-13(18)8-9-14-16(15)21-24-20-14/h4-9H,2-3,10H2,1H3,(H,19,22)

InChI Key

DJEMSYKBCKVCBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07087034

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.764

Distribution Coefficient, logD

4.576

Water Solubility, LogSw

-4.82

Polar Surface Area

50.304

Acid Dissociation Constant (pKa)

7.67

Base Dissociation Constant (pKb)

-1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

7888-0679 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 7888-0679 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7888-0679?
Check Price and Availability of 7888-0679, 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 7888-0679 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7888-0679
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7888-0679
  • 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 7888-0679 available by request