E157-4274 Screening compound: N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pentanamide

E157-4274 Screening compound: N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pentanamide
E157-4274 Screening compound: N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-4274
N-[3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pentanamide

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

E157-4274

Molecular Formula

C12H13N5O2S (C12 H13 N5 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCCCC(Nc(s1)nn2c1nnc2-c1ccco1)=O

InChI

InChI=1S/C12H13N5O2S/c1-2-3-6-9(18)13-11-16-17-10(8-5-4-7-19-8)14-15-12(17)20-11/h4-5,7H,2-3,6H2,1H3,(H,13,16,18)

InChI Key

ZZQKRTIBBZEASP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843966

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.841

Distribution Coefficient, logD

1.839

Water Solubility, LogSw

-2.36

Polar Surface Area

65.762

Acid Dissociation Constant (pKa)

9.71

Base Dissociation Constant (pKb)

-1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

E157-4274 in Drug Discovery

Included in Screening Libraries

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

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with E157-4274 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-4274?
Check Price and Availability of E157-4274, 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 E157-4274 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-4274
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-4274
  • 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 E157-4274 available by request