L388-0160 Screening compound: 5-{[3-(2H-1,3-BENZODIOXOL-5-YL)-1,2,4-OXADIAZOL-5-YL]METHYL}-8-OXA-3,5-DIAZATRICYCLO[7.4.0.0^(2,7)]TRIDECA-1(13),2(7),3,9,11-PENTAEN-6-ONE

L388-0160 Screening compound: 5-{[3-(2H-1,3-BENZODIOXOL-5-YL)-1,2,4-OXADIAZOL-5-YL]METHYL}-8-OXA-3,5-DIAZATRICYCLO[7.4.0.0^(2,7)]TRIDECA-1(13),2(7),3,9,11-PENTAEN-6-ONE
L388-0160 Screening compound: 5-{[3-(2H-1,3-BENZODIOXOL-5-YL)-1,2,4-OXADIAZOL-5-YL]METHYL}-8-OXA-3,5-DIAZATRICYCLO[7.4.0.0^(2,7)]TRIDECA-1(13),2(7),3,9,11-PENTAEN-6-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound L388-0160
5-{[3-(2H-1,3-BENZODIOXOL-5-YL)-1,2,4-OXADIAZOL-5-YL]METHYL}-8-OXA-3,5-DIAZATRICYCLO[7.4.0.0^(2,7)]TRIDECA-1(13),2(7),3,9,11-PENTAEN-6-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

L388-0160

Molecular Formula

C20H12N4O5 (C20 H12 N4 O5)

Compound Name

5-{[3-(2H-1,3-BENZODIOXOL-5-YL)-1,2,4-OXADIAZOL-5-YL]METHYL}-8-OXA-3,5-DIAZATRICYCLO[7.4.0.0^(2,7)]TRIDECA-1(13),2(7),3,9,11-PENTAEN-6-ONE

IUPAC name

5-{[3-(2H-13-benzodioxol-5-yl)-124-oxadiazol-5-yl]methyl}-8-oxa-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-6-one

SMILES

O=C1N(Cc2nc(-c(cc3)cc4c3OCO4)no2)C=Nc2c1oc1c2cccc1

InChI

InChI=1S/C20H12N4O5/c25-20-18-17(12-3-1-2-4-13(12)28-18)21-9-24(20)8-16-22-19(23-29-16)11-5-6-14-15(7-11)27-10-26-14/h1-7,9H,8,10H2

InChI Key

ZKMKEQJXJOPPPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27250219

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.34

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.625

Distribution Coefficient, logD

3.625

Water Solubility, LogSw

-4.06

Polar Surface Area

80.693

Acid Dissociation Constant (pKa)

34.13

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

L388-0160 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with L388-0160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L388-0160?
Check Price and Availability of L388-0160, 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 L388-0160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L388-0160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L388-0160
  • 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 L388-0160 available by request