E157-3699 Screening compound: N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide

E157-3699 Screening compound: N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide
E157-3699 Screening compound: N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-3699
N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide

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

E157-3699

Molecular Formula

C17H15N5O5S (C17 H15 N5 O5 S)

Compound Name

N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide

IUPAC name

N-[3-(furan-2-yl)-[124]triazolo[34-b][134]thiadiazol-6-yl]-345-trimethoxybenzamide

SMILES

COc1cc(C(Nc(s2)nn3c2nnc3-c2ccco2)=O)cc(OC)c1OC

InChI

InChI=1S/C17H15N5O5S/c1-24-11-7-9(8-12(25-2)13(11)26-3)15(23)18-16-21-22-14(10-5-4-6-27-10)19-20-17(22)28-16/h4-8H,1-3H3,(H,18,21,23)

InChI Key

JALYAYYWJRODIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843868

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.033

Distribution Coefficient, logD

2.032

Water Solubility, LogSw

-2.89

Polar Surface Area

88.682

Acid Dissociation Constant (pKa)

9.92

Base Dissociation Constant (pKb)

-1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

E157-3699 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E157-3699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-3699?
Check Price and Availability of E157-3699, 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 E157-3699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-3699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-3699
  • 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 E157-3699 available by request