3388-0617 Screening compound: N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide

3388-0617 Screening compound: N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide
3388-0617 Screening compound: N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3388-0617
N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide

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

3388-0617

Molecular Formula

C15H13N3O4S (C15 H13 N3 O4 S)

Compound Name

N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide

IUPAC name

N-[5-(34-dimethoxyphenyl)-134-thiadiazol-2-yl]furan-2-carboxamide

SMILES

COc(ccc(-c1nnc(NC(c2ccco2)=O)s1)c1)c1OC

InChI

InChI=1S/C15H13N3O4S/c1-20-10-6-5-9(8-12(10)21-2)14-17-18-15(23-14)16-13(19)11-4-3-7-22-11/h3-8H,1-2H3,(H,16,18,19)

InChI Key

BCTMSKNXHGDFMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00845229

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.708

Distribution Coefficient, logD

2.707

Water Solubility, LogSw

-3.39

Polar Surface Area

70.442

Acid Dissociation Constant (pKa)

9.76

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

3388-0617 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Aging Library (44940 compounds)

Antimitotic Tubulin Library (17355 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3388-0617 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3388-0617?
Check Price and Availability of 3388-0617, 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 3388-0617 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3388-0617
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3388-0617
  • 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 3388-0617 available by request