E157-1024 Screening compound: 3,4,5-triethoxy-N-[5-(morpholine-4-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide

E157-1024 Screening compound: 3,4,5-triethoxy-N-[5-(morpholine-4-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide
E157-1024 Screening compound: 3,4,5-triethoxy-N-[5-(morpholine-4-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-1024
3,4,5-triethoxy-N-[5-(morpholine-4-sulfonyl)-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

E157-1024

Molecular Formula

C19H26N4O7S2 (C19 H26 N4 O7 S2)

Compound Name

3,4,5-triethoxy-N-[5-(morpholine-4-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide

IUPAC name

345-triethoxy-N-[5-(morpholine-4-sulfonyl)-134-thiadiazol-2-yl]benzamide

SMILES

CCOc1cc(C(Nc(s2)nnc2S(N2CCOCC2)(=O)=O)=O)cc(OCC)c1OCC

InChI

InChI=1S/C19H26N4O7S2/c1-4-28-14-11-13(12-15(29-5-2)16(14)30-6-3)17(24)20-18-21-22-19(31-18)32(25,26)23-7-9-27-10-8-23/h11-12H,4-10H2,1-3H3,(H,20,21,24)

InChI Key

JTFITPYUTXNVBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843502

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.57

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.443

Distribution Coefficient, logD

2.099

Water Solubility, LogSw

-3.05

Polar Surface Area

107.986

Acid Dissociation Constant (pKa)

7.32

Base Dissociation Constant (pKb)

-7.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

E157-1024 in Drug Discovery

Included in Screening Libraries

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

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E157-1024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-1024?
Check Price and Availability of E157-1024, 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 E157-1024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-1024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-1024
  • 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 E157-1024 available by request