G534-2682 Screening compound: N-(3,4-dimethylphenyl)-2-[(1-{[(2,6-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide

G534-2682 Screening compound: N-(3,4-dimethylphenyl)-2-[(1-{[(2,6-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide
G534-2682 Screening compound: N-(3,4-dimethylphenyl)-2-[(1-{[(2,6-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G534-2682
N-(3,4-dimethylphenyl)-2-[(1-{[(2,6-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

G534-2682

Molecular Formula

C27H28N4O2S (C27 H28 N4 O2 S)

Compound Name

N-(3,4-dimethylphenyl)-2-[(1-{[(2,6-dimethylphenyl)carbamoyl]methyl}-1H-1,3-benzodiazol-2-yl)sulfanyl]acetamide

IUPAC name

N-(34-dimethylphenyl)-2-[(1-{[(26-dimethylphenyl)carbamoyl]methyl}-1H-13-benzodiazol-2-yl)sulfanyl]acetamide

SMILES

Cc(cc1)c(C)cc1NC(CSc1nc(cccc2)c2n1CC(Nc1c(C)cccc1C)=O)=O

InChI

InChI=1S/C27H28N4O2S/c1-17-12-13-21(14-20(17)4)28-25(33)16-34-27-29-22-10-5-6-11-23(22)31(27)15-24(32)30-26-18(2)8-7-9-19(26)3/h5-14H,15-16H2,1-4H3,(H,28,33)(H,30,32)

InChI Key

HQMIHTKLDOOLAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15016934

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.61

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.955

Distribution Coefficient, logD

5.955

Water Solubility, LogSw

-5.41

Polar Surface Area

55.380

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with G534-2682 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G534-2682?
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What is the minimum amount of G534-2682 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G534-2682
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G534-2682
  • 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 G534-2682 available by request