2357-3592 Screening compound: 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(methylsulfanyl)phenyl]methylidene]acetohydrazide

2357-3592 Screening compound: 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(methylsulfanyl)phenyl]methylidene]acetohydrazide
2357-3592 Screening compound: 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(methylsulfanyl)phenyl]methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2357-3592
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(methylsulfanyl)phenyl]methylidene]acetohydrazide

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

2357-3592

Molecular Formula

C26H25N5O3S2 (C26 H25 N5 O3 S2)

Compound Name

2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(methylsulfanyl)phenyl]methylidene]acetohydrazide

IUPAC name

2-{[5-(34-dimethoxyphenyl)-4-phenyl-4H-124-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(methylsulfanyl)phenyl]methylidene]acetohydrazide

SMILES

COc(ccc(-c(n1-c2ccccc2)nnc1SCC(N/N=C/c(cc1)ccc1SC)=O)c1)c1OC

InChI

InChI=1S/C26H25N5O3S2/c1-33-22-14-11-19(15-23(22)34-2)25-29-30-26(31(25)20-7-5-4-6-8-20)36-17-24(32)28-27-16-18-9-12-21(35-3)13-10-18/h4-16H,17H2,1-3H3,(H,28,32)

InChI Key

CFEIQUPHSZIMTD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01841597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

519.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.832

Distribution Coefficient, logD

4.832

Water Solubility, LogSw

-4.66

Polar Surface Area

75.347

Acid Dissociation Constant (pKa)

10.79

Base Dissociation Constant (pKb)

0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 2357-3592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2357-3592?
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What is the minimum amount of 2357-3592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2357-3592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2357-3592
  • 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 2357-3592 available by request