L849-1478 Screening compound: N-(3-chloro-2-methylphenyl)-2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

L849-1478 Screening compound: N-(3-chloro-2-methylphenyl)-2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
L849-1478 Screening compound: N-(3-chloro-2-methylphenyl)-2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L849-1478
N-(3-chloro-2-methylphenyl)-2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-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

L849-1478

Molecular Formula

C23H23ClN6OS (C23 H23 ClN6 OS)

Compound Name

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

IUPAC name

N-(3-chloro-2-methylphenyl)-2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-124-triazol-3-yl]sulfanyl}acetamide

SMILES

CCn1c(SCC(Nc2cccc(Cl)c2C)=O)nnc1-c1cn(C)nc1-c1ccccc1

InChI

InChI=1S/C23H23ClN6OS/c1-4-30-22(17-13-29(3)28-21(17)16-9-6-5-7-10-16)26-27-23(30)32-14-20(31)25-19-12-8-11-18(24)15(19)2/h5-13H,4,14H2,1-3H3,(H,25,31)

InChI Key

LRDCVODCLGENRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27479739

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.99

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.154

Distribution Coefficient, logD

4.154

Water Solubility, LogSw

-4.49

Polar Surface Area

61.501

Acid Dissociation Constant (pKa)

10.68

Base Dissociation Constant (pKb)

3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

L849-1478 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Immunological Library (6760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system

References: we are preparing a list of scientific research reports with L849-1478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L849-1478?
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What is the minimum amount of L849-1478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L849-1478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L849-1478
  • 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 L849-1478 available by request