2357-3692 Screening compound: 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(dimethylamino)phenyl]methylidene]acetohydrazide

2357-3692 Screening compound: 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(dimethylamino)phenyl]methylidene]acetohydrazide
2357-3692 Screening compound: 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(dimethylamino)phenyl]methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2357-3692
2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-[4-(dimethylamino)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

2357-3692

Molecular Formula

C25H23ClN6OS (C25 H23 ClN6 OS)

Compound Name

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

IUPAC name

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

SMILES

CN(C)c1ccc(/C=N/NC(CSc2nnc(-c(cc3)ccc3Cl)n2-c2ccccc2)=O)cc1

InChI

InChI=1S/C25H23ClN6OS/c1-31(2)21-14-8-18(9-15-21)16-27-28-23(33)17-34-25-30-29-24(19-10-12-20(26)13-11-19)32(25)22-6-4-3-5-7-22/h3-16H,17H2,1-2H3,(H,28,33)

InChI Key

FAGMWHNINQMIEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01586835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.02

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.175

Distribution Coefficient, logD

5.174

Water Solubility, LogSw

-5.84

Polar Surface Area

62.891

Acid Dissociation Constant (pKa)

10.79

Base Dissociation Constant (pKb)

8.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

2357-3692 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with 2357-3692 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2357-3692?
Check Price and Availability of 2357-3692, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 2357-3692 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2357-3692
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2357-3692
  • 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 2357-3692 available by request