G534-0518 Screening compound: N-benzyl-2-[(1-{[(2,4-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide

G534-0518 Screening compound: N-benzyl-2-[(1-{[(2,4-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide
G534-0518 Screening compound: N-benzyl-2-[(1-{[(2,4-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G534-0518
N-benzyl-2-[(1-{[(2,4-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-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

G534-0518

Molecular Formula

C26H26N4O2S (C26 H26 N4 O2 S)

Compound Name

N-benzyl-2-[(1-{[(2,4-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide

IUPAC name

N-benzyl-2-[(1-{[(24-dimethylphenyl)carbamoyl]methyl}-1H-13-benzodiazol-2-yl)sulfanyl]acetamide

SMILES

Cc(cc1)cc(C)c1NC(Cn1c(SCC(NCc2ccccc2)=O)nc2c1cccc2)=O

InChI

InChI=1S/C26H26N4O2S/c1-18-12-13-21(19(2)14-18)28-24(31)16-30-23-11-7-6-10-22(23)29-26(30)33-17-25(32)27-15-20-8-4-3-5-9-20/h3-14H,15-17H2,1-2H3,(H,27,32)(H,28,31)

InChI Key

HKTHNZFJQQEOBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15016678

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.947

Distribution Coefficient, logD

4.946

Water Solubility, LogSw

-4.62

Polar Surface Area

57.400

Acid Dissociation Constant (pKa)

12.04

Base Dissociation Constant (pKb)

4.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with G534-0518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G534-0518?
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What is the minimum amount of G534-0518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G534-0518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G534-0518
  • 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 G534-0518 available by request