L834-1064 Screening compound: 6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-3-one

L834-1064 Screening compound: 6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-3-one
L834-1064 Screening compound: 6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L834-1064
6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-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

L834-1064

Molecular Formula

C18H17N3O3S (C18 H17 N3 O3 S)

Compound Name

6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-3-one

IUPAC name

6-[5-(3-methylthiophen-2-yl)-124-oxadiazol-3-yl]-4-propyl-34-dihydro-2H-14-benzoxazin-3-one

SMILES

CCCN1c(cc(cc2)-c3noc(-c4c(C)ccs4)n3)c2OCC1=O

InChI

InChI=1S/C18H17N3O3S/c1-3-7-21-13-9-12(4-5-14(13)23-10-15(21)22)17-19-18(24-20-17)16-11(2)6-8-25-16/h4-6,8-9H,3,7,10H2,1-2H3

InChI Key

IJTXAPIUOGEBQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27478947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.058

Distribution Coefficient, logD

4.058

Water Solubility, LogSw

-4.10

Polar Surface Area

56.742

Acid Dissociation Constant (pKa)

21.08

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

L834-1064 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L834-1064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L834-1064?
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What is the minimum amount of L834-1064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L834-1064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L834-1064
  • 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 L834-1064 available by request