L850-0028 Screening compound: 2-({4-ethyl-5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-ethylphenyl)acetamide

L850-0028 Screening compound: 2-({4-ethyl-5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-ethylphenyl)acetamide
L850-0028 Screening compound: 2-({4-ethyl-5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-ethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L850-0028
2-({4-ethyl-5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-ethylphenyl)acetamide

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

L850-0028

Molecular Formula

C23H24N6O3S (C23 H24 N6 O3 S)

Compound Name

2-({4-ethyl-5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-ethylphenyl)acetamide

IUPAC name

2-({4-ethyl-5-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]-4H-124-triazol-3-yl}sulfanyl)-N-(3-ethylphenyl)acetamide

SMILES

CCc1cccc(NC(CSc2nnc(-c3nc(-c(cc4)ccc4OC)no3)n2CC)=O)c1

InChI

InChI=1S/C23H24N6O3S/c1-4-15-7-6-8-17(13-15)24-19(30)14-33-23-27-26-21(29(23)5-2)22-25-20(28-32-22)16-9-11-18(31-3)12-10-16/h6-13H,4-5,14H2,1-3H3,(H,24,30)

InChI Key

WGKHMLNIWJOBAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27479869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.876

Distribution Coefficient, logD

4.876

Water Solubility, LogSw

-4.67

Polar Surface Area

86.336

Acid Dissociation Constant (pKa)

13.00

Base Dissociation Constant (pKb)

0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with L850-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L850-0028?
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What is the minimum amount of L850-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L850-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L850-0028
  • 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 L850-0028 available by request