L683-0379 Screening compound: N~1~-(2-ethylphenyl)-2-{[6-methyl-4-(4-methylbenzyl)-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide

L683-0379 Screening compound: N~1~-(2-ethylphenyl)-2-{[6-methyl-4-(4-methylbenzyl)-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide
L683-0379 Screening compound: N~1~-(2-ethylphenyl)-2-{[6-methyl-4-(4-methylbenzyl)-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L683-0379
N~1~-(2-ethylphenyl)-2-{[6-methyl-4-(4-methylbenzyl)-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-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

L683-0379

Molecular Formula

C25H25N7O2S (C25 H25 N7 O2 S)

Compound Name

N~1~-(2-ethylphenyl)-2-{[6-methyl-4-(4-methylbenzyl)-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide

IUPAC name

N-(2-ethylphenyl)-2-({5-methyl-8-[(4-methylphenyl)methyl]-7-oxo-14581011-hexaazatricyclo[7.3.0.0^{26}]dodeca-2(6)3911-tetraen-12-yl}sulfanyl)acetamide

SMILES

CCc(cccc1)c1NC(CSc(n1-c2c3n(C)nc2)nnc1N(Cc1ccc(C)cc1)C3=O)=O

InChI

InChI=1S/C25H25N7O2S/c1-4-18-7-5-6-8-19(18)27-21(33)15-35-25-29-28-24-31(14-17-11-9-16(2)10-12-17)23(34)22-20(32(24)25)13-26-30(22)3/h5-13H,4,14-15H2,1-3H3,(H,27,33)

InChI Key

BAXJJHYHGBFOPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27469525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.473

Distribution Coefficient, logD

3.473

Water Solubility, LogSw

-3.59

Polar Surface Area

75.891

Acid Dissociation Constant (pKa)

13.10

Base Dissociation Constant (pKb)

0.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

L683-0379 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

PI3K-Targeted Library (17255 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Immune system
Targets:
  • GPCR
  • Ion Channels
  • Kinases
  • Proteases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L683-0379 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L683-0379?
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What is the minimum amount of L683-0379 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L683-0379
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L683-0379
  • 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 L683-0379 available by request