L102-0544 Screening compound: 2-{2-[1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}-1,2,3,4-tetrahydroisoquinoline

L102-0544 Screening compound: 2-{2-[1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}-1,2,3,4-tetrahydroisoquinoline
L102-0544 Screening compound: 2-{2-[1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound L102-0544
2-{2-[1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}-1,2,3,4-tetrahydroisoquinoline

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

L102-0544

Molecular Formula

C24H23N5O2S (C24 H23 N5 O2 S)

Compound Name

2-{2-[1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-{2-[1-(3-methoxyphenyl)-5-methyl-1H-123-triazol-4-yl]-4-methyl-13-thiazole-5-carbonyl}-1234-tetrahydroisoquinoline

SMILES

Cc1c(-c2nc(C)c(C(N(CC3)Cc4c3cccc4)=O)s2)nnn1-c1cc(OC)ccc1

InChI

InChI=1S/C24H23N5O2S/c1-15-22(24(30)28-12-11-17-7-4-5-8-18(17)14-28)32-23(25-15)21-16(2)29(27-26-21)19-9-6-10-20(13-19)31-3/h4-10,13H,11-12,14H2,1-3H3

InChI Key

WWUWJWVZQLUKGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27232302

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.407

Distribution Coefficient, logD

4.407

Water Solubility, LogSw

-4.38

Polar Surface Area

61.246

Acid Dissociation Constant (pKa)

23.14

Base Dissociation Constant (pKb)

1.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

L102-0544 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L102-0544 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L102-0544?
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What is the minimum amount of L102-0544 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L102-0544
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L102-0544
  • 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 L102-0544 available by request