E157-0612 Screening compound: N-[5-(benzylsulfamoyl)-1,3,4-thiadiazol-2-yl]-4-chlorobenzamide

E157-0612 Screening compound: N-[5-(benzylsulfamoyl)-1,3,4-thiadiazol-2-yl]-4-chlorobenzamide
E157-0612 Screening compound: N-[5-(benzylsulfamoyl)-1,3,4-thiadiazol-2-yl]-4-chlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-0612
N-[5-(benzylsulfamoyl)-1,3,4-thiadiazol-2-yl]-4-chlorobenzamide

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

E157-0612

Molecular Formula

C16H13ClN4O3S2 (C16 H13 ClN4 O3 S2)

Compound Name

N-[5-(benzylsulfamoyl)-1,3,4-thiadiazol-2-yl]-4-chlorobenzamide

IUPAC name

N-[5-(benzylsulfamoyl)-134-thiadiazol-2-yl]-4-chlorobenzamide

SMILES

O=C(c(cc1)ccc1Cl)Nc(s1)nnc1S(NCc1ccccc1)(=O)=O

InChI

InChI=1S/C16H13ClN4O3S2/c17-13-8-6-12(7-9-13)14(22)19-15-20-21-16(25-15)26(23,24)18-10-11-4-2-1-3-5-11/h1-9,18H,10H2,(H,19,20,22)

InChI Key

CYQIGLSKLYYGDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843412

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.89

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.930

Distribution Coefficient, logD

1.387

Water Solubility, LogSw

-4.62

Polar Surface Area

88.408

Acid Dissociation Constant (pKa)

4.86

Base Dissociation Constant (pKb)

-7.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

E157-0612 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E157-0612 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-0612?
Check Price and Availability of E157-0612, 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 E157-0612 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-0612
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-0612
  • 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 E157-0612 available by request