L471-1648 Screening compound: 1-{4-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]phenyl}azepane

L471-1648 Screening compound: 1-{4-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]phenyl}azepane
L471-1648 Screening compound: 1-{4-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]phenyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound L471-1648
1-{4-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]phenyl}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

L471-1648

Molecular Formula

C19H24N4O2 (C19 H24 N4 O2)

Compound Name

1-{4-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]phenyl}azepane

IUPAC name

1-{4-[5-(pyrrolidine-1-carbonyl)-124-oxadiazol-3-yl]phenyl}azepane

SMILES

O=C(c1nc(-c(cc2)ccc2N2CCCCCC2)no1)N1CCCC1

InChI

InChI=1S/C19H24N4O2/c24-19(23-13-5-6-14-23)18-20-17(21-25-18)15-7-9-16(10-8-15)22-11-3-1-2-4-12-22/h7-10H,1-6,11-14H2

InChI Key

GCNUMAOJEBKMMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27454774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.931

Distribution Coefficient, logD

3.931

Water Solubility, LogSw

-4.01

Polar Surface Area

52.714

Acid Dissociation Constant (pKa)

27.56

Base Dissociation Constant (pKb)

4.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

L471-1648 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

CNS BBB Library (22607 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with L471-1648 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L471-1648?
Check Price and Availability of L471-1648, 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 L471-1648 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L471-1648
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L471-1648
  • 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 L471-1648 available by request