L102-1043 Screening compound: 2-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide

L102-1043 Screening compound: 2-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide
L102-1043 Screening compound: 2-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L102-1043
2-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide

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

L102-1043

Molecular Formula

C23H22ClN5O3S (C23 H22 ClN5 O3 S)

Compound Name

2-[1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide

IUPAC name

2-[1-(3-chlorophenyl)-5-methyl-1H-123-triazol-4-yl]-N-[(25-dimethoxyphenyl)methyl]-4-methyl-13-thiazole-5-carboxamide

SMILES

Cc1c(-c2nc(C)c(C(NCc(cc(cc3)OC)c3OC)=O)s2)nnn1-c1cccc(Cl)c1

InChI

InChI=1S/C23H22ClN5O3S/c1-13-21(22(30)25-12-15-10-18(31-3)8-9-19(15)32-4)33-23(26-13)20-14(2)29(28-27-20)17-7-5-6-16(24)11-17/h5-11H,12H2,1-4H3,(H,25,30)

InChI Key

MCVVXPLERLJDAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27232365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.98

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.627

Distribution Coefficient, logD

4.627

Water Solubility, LogSw

-4.76

Polar Surface Area

76.980

Acid Dissociation Constant (pKa)

12.38

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

L102-1043 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • 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 L102-1043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L102-1043?
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What is the minimum amount of L102-1043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L102-1043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L102-1043
  • 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 L102-1043 available by request