D677-0440 Screening compound: 2,4-dimethyl-N-{[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

D677-0440 Screening compound: 2,4-dimethyl-N-{[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide
D677-0440 Screening compound: 2,4-dimethyl-N-{[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D677-0440
2,4-dimethyl-N-{[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

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

D677-0440

Molecular Formula

C16H15N3O2S (C16 H15 N3 O2 S)

Compound Name

2,4-dimethyl-N-{[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

IUPAC name

24-dimethyl-N-{[5-(thiophen-2-yl)-124-oxadiazol-3-yl]methyl}benzamide

SMILES

Cc(cc1)cc(C)c1C(NCc1noc(-c2cccs2)n1)=O

InChI

InChI=1S/C16H15N3O2S/c1-10-5-6-12(11(2)8-10)15(20)17-9-14-18-16(21-19-14)13-4-3-7-22-13/h3-8H,9H2,1-2H3,(H,17,20)

InChI Key

OHJPURAYPJFBMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27595843

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.905

Distribution Coefficient, logD

3.905

Water Solubility, LogSw

-3.85

Polar Surface Area

58.338

Acid Dissociation Constant (pKa)

12.23

Base Dissociation Constant (pKb)

-5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

References: we are preparing a list of scientific research reports with D677-0440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D677-0440?
Check Price and Availability of D677-0440, 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 D677-0440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D677-0440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D677-0440
  • 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 D677-0440 available by request