F987-0285 Screening compound: 1-({3-methyl-2-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-yl}sulfonyl)azepane

F987-0285 Screening compound: 1-({3-methyl-2-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-yl}sulfonyl)azepane
F987-0285 Screening compound: 1-({3-methyl-2-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-yl}sulfonyl)azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound F987-0285
1-({3-methyl-2-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-yl}sulfonyl)azepane

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

F987-0285

Molecular Formula

C21H21N3O4S2 (C21 H21 N3 O4 S2)

Compound Name

1-({3-methyl-2-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-yl}sulfonyl)azepane

IUPAC name

1-({3-methyl-2-[3-(thiophen-2-yl)-124-oxadiazol-5-yl]-1-benzofuran-5-yl}sulfonyl)azepane

SMILES

Cc1c(-c2nc(-c3cccs3)no2)oc(cc2)c1cc2S(N1CCCCCC1)(=O)=O

InChI

InChI=1S/C21H21N3O4S2/c1-14-16-13-15(30(25,26)24-10-4-2-3-5-11-24)8-9-17(16)27-19(14)21-22-20(23-28-21)18-7-6-12-29-18/h6-9,12-13H,2-5,10-11H2,1H3

InChI Key

YUWCPVRXAXCQIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16638562

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.500

Distribution Coefficient, logD

5.500

Water Solubility, LogSw

-5.49

Polar Surface Area

73.230

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

-3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with F987-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F987-0285?
Check Price and Availability of F987-0285, 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 F987-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F987-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F987-0285
  • 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 F987-0285 available by request