L309-1291 Screening compound: 4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one

L309-1291 Screening compound: 4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one
L309-1291 Screening compound: 4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L309-1291
4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one

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

L309-1291

Molecular Formula

C20H25N5O5S (C20 H25 N5 O5 S)

Compound Name

4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one

IUPAC name

4-[(5-cyclobutyl-124-oxadiazol-3-yl)methyl]-6-[(4-methylpiperazin-1-yl)sulfonyl]-34-dihydro-2H-14-benzoxazin-3-one

SMILES

CN(CC1)CCN1S(c(cc1)cc(N2Cc3noc(C4CCC4)n3)c1OCC2=O)(=O)=O

InChI

InChI=1S/C20H25N5O5S/c1-23-7-9-24(10-8-23)31(27,28)15-5-6-17-16(11-15)25(19(26)13-29-17)12-18-21-20(30-22-18)14-3-2-4-14/h5-6,11,14H,2-4,7-10,12-13H2,1H3

InChI Key

JTNBINCJKHLGEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27244179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.52

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.222

Distribution Coefficient, logD

1.160

Water Solubility, LogSw

-2.51

Polar Surface Area

92.447

Acid Dissociation Constant (pKa)

20.50

Base Dissociation Constant (pKb)

6.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

L309-1291 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

GPCR Targeted Library (31838 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L309-1291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L309-1291?
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What is the minimum amount of L309-1291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L309-1291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L309-1291
  • 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 L309-1291 available by request