E157-1202 Screening compound: 2-(4-fluorophenoxy)-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]acetamide

E157-1202 Screening compound: 2-(4-fluorophenoxy)-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]acetamide
E157-1202 Screening compound: 2-(4-fluorophenoxy)-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-1202
2-(4-fluorophenoxy)-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]acetamide

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

E157-1202

Molecular Formula

C14H15FN4O4S2 (C14 H15 FN4 O4 S2)

Compound Name

2-(4-fluorophenoxy)-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]acetamide

IUPAC name

2-(4-fluorophenoxy)-N-[5-(pyrrolidine-1-sulfonyl)-134-thiadiazol-2-yl]acetamide

SMILES

O=C(COc(cc1)ccc1F)Nc(s1)nnc1S(N1CCCC1)(=O)=O

InChI

InChI=1S/C14H15FN4O4S2/c15-10-3-5-11(6-4-10)23-9-12(20)16-13-17-18-14(24-13)25(21,22)19-7-1-2-8-19/h3-6H,1-2,7-9H2,(H,16,17,20)

InChI Key

CXVKOGDOWIWDHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.326

Distribution Coefficient, logD

1.946

Water Solubility, LogSw

-2.96

Polar Surface Area

86.012

Acid Dissociation Constant (pKa)

7.25

Base Dissociation Constant (pKb)

-5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

E157-1202 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

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)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E157-1202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-1202?
Check Price and Availability of E157-1202, 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 E157-1202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-1202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-1202
  • 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 E157-1202 available by request