3388-0855 Screening compound: N-{5-[(4-ethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-methoxybenzamide

3388-0855 Screening compound: N-{5-[(4-ethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-methoxybenzamide
3388-0855 Screening compound: N-{5-[(4-ethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3388-0855
N-{5-[(4-ethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-methoxybenzamide

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

3388-0855

Molecular Formula

C19H19N3O3S (C19 H19 N3 O3 S)

Compound Name

N-{5-[(4-ethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-methoxybenzamide

IUPAC name

N-{5-[(4-ethylphenoxy)methyl]-134-thiadiazol-2-yl}-4-methoxybenzamide

SMILES

CCc(cc1)ccc1OCc1nnc(NC(c(cc2)ccc2OC)=O)s1

InChI

InChI=1S/C19H19N3O3S/c1-3-13-4-8-16(9-5-13)25-12-17-21-22-19(26-17)20-18(23)14-6-10-15(24-2)11-7-14/h4-11H,3,12H2,1-2H3,(H,20,22,23)

InChI Key

REQCRWBDRRFISZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01446403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.461

Distribution Coefficient, logD

3.735

Water Solubility, LogSw

-4.21

Polar Surface Area

62.141

Acid Dissociation Constant (pKa)

6.77

Base Dissociation Constant (pKb)

-4.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

3388-0855 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Others
  • Kinases

References: we are preparing a list of scientific research reports with 3388-0855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3388-0855?
Check Price and Availability of 3388-0855, 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 3388-0855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3388-0855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3388-0855
  • 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 3388-0855 available by request