L791-0060 Screening compound: 1-[(furan-2-yl)methyl]-3-(5-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea

L791-0060 Screening compound: 1-[(furan-2-yl)methyl]-3-(5-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea
L791-0060 Screening compound: 1-[(furan-2-yl)methyl]-3-(5-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L791-0060
1-[(furan-2-yl)methyl]-3-(5-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea

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

L791-0060

Molecular Formula

C17H14N6O3S2 (C17 H14 N6 O3 S2)

Compound Name

1-[(furan-2-yl)methyl]-3-(5-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea

IUPAC name

1-[(furan-2-yl)methyl]-3-(5-{[(5-phenyl-134-oxadiazol-2-yl)methyl]sulfanyl}-134-thiadiazol-2-yl)urea

SMILES

O=C(NCc1ccco1)Nc1nnc(SCc2nnc(-c3ccccc3)o2)s1

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.531

Distribution Coefficient, logD

3.531

Water Solubility, LogSw

-3.65

Polar Surface Area

94.428

Acid Dissociation Constant (pKa)

11.05

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

L791-0060 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L791-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L791-0060?
Check Price and Availability of L791-0060, 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 L791-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L791-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L791-0060
  • 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 L791-0060 available by request