2357-3371 Screening compound: 2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide

2357-3371 Screening compound: 2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide
2357-3371 Screening compound: 2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2357-3371
2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]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

2357-3371

Molecular Formula

C23H22BrN5OS (C23 H22 BrN5 OS)

Compound Name

2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide

IUPAC name

2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-124-triazol-3-yl]sulfanyl}-N'-[(1E2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide

SMILES

CC(Cn1c(SCC(N/N=C/C=C/c2ccccc2)=O)nnc1-c(cc1)ccc1Br)=C

InChI

InChI=1S/C23H22BrN5OS/c1-17(2)15-29-22(19-10-12-20(24)13-11-19)27-28-23(29)31-16-21(30)26-25-14-6-9-18-7-4-3-5-8-18/h3-14H,1,15-16H2,2H3,(H,26,30)

InChI Key

VUPKSIPRNIXBRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01841524

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.642

Distribution Coefficient, logD

5.641

Water Solubility, LogSw

-5.53

Polar Surface Area

60.246

Acid Dissociation Constant (pKa)

10.58

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with 2357-3371 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2357-3371?
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What is the minimum amount of 2357-3371 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2357-3371
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2357-3371
  • 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 2357-3371 available by request