L102-0417 Screening compound: 2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-[(4-methylphenyl)methyl]-1,3-thiazole-5-carboxamide

L102-0417 Screening compound: 2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-[(4-methylphenyl)methyl]-1,3-thiazole-5-carboxamide
L102-0417 Screening compound: 2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-[(4-methylphenyl)methyl]-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L102-0417
2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-[(4-methylphenyl)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

L102-0417

Molecular Formula

C24H25N5OS (C24 H25 N5 OS)

Compound Name

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

IUPAC name

2-[1-(34-dimethylphenyl)-5-methyl-1H-123-triazol-4-yl]-4-methyl-N-[(4-methylphenyl)methyl]-13-thiazole-5-carboxamide

SMILES

Cc1c(-c2nc(C)c(C(NCc3ccc(C)cc3)=O)s2)nnn1-c1cc(C)c(C)cc1

InChI

InChI=1S/C24H25N5OS/c1-14-6-9-19(10-7-14)13-25-23(30)22-17(4)26-24(31-22)21-18(5)29(28-27-21)20-11-8-15(2)16(3)12-20/h6-12H,13H2,1-5H3,(H,25,30)

InChI Key

VBPFTIJYRBKACZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27232283

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.343

Distribution Coefficient, logD

5.343

Water Solubility, LogSw

-5.23

Polar Surface Area

61.806

Acid Dissociation Constant (pKa)

11.88

Base Dissociation Constant (pKb)

3.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

L102-0417 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L102-0417 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L102-0417?
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What is the minimum amount of L102-0417 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L102-0417
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L102-0417
  • 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 L102-0417 available by request