L850-1892 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

L850-1892 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
L850-1892 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L850-1892
N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}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

L850-1892

Molecular Formula

C22H20N8O2S (C22 H20 N8 O2 S)

Compound Name

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

IUPAC name

N-[2-(1H-13-benzodiazol-2-yl)ethyl]-2-{[4-methyl-5-(3-phenyl-124-oxadiazol-5-yl)-4H-124-triazol-3-yl]sulfanyl}acetamide

SMILES

Cn1c(SCC(NCCc2nc(cccc3)c3[nH]2)=O)nnc1-c1nc(-c2ccccc2)no1

InChI

InChI=1S/C22H20N8O2S/c1-30-20(21-26-19(29-32-21)14-7-3-2-4-8-14)27-28-22(30)33-13-18(31)23-12-11-17-24-15-9-5-6-10-16(15)25-17/h2-10H,11-13H2,1H3,(H,23,31)(H,24,25)

InChI Key

XJHYINUOSGKJSY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27480205

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.717

Distribution Coefficient, logD

2.704

Water Solubility, LogSw

-3.07

Polar Surface Area

101.323

Acid Dissociation Constant (pKa)

13.46

Base Dissociation Constant (pKb)

5.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with L850-1892 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L850-1892?
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What is the minimum amount of L850-1892 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L850-1892
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L850-1892
  • 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 L850-1892 available by request