5617-1005 Screening compound: 3-[(2E)-2-{[4-(methylsulfanyl)phenyl]methylidene}hydrazin-1-yl]-5-phenyl-1,2,4-triazine

5617-1005 Screening compound: 3-[(2E)-2-{[4-(methylsulfanyl)phenyl]methylidene}hydrazin-1-yl]-5-phenyl-1,2,4-triazine
5617-1005 Screening compound: 3-[(2E)-2-{[4-(methylsulfanyl)phenyl]methylidene}hydrazin-1-yl]-5-phenyl-1,2,4-triazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5617-1005
3-[(2E)-2-{[4-(methylsulfanyl)phenyl]methylidene}hydrazin-1-yl]-5-phenyl-1,2,4-triazine

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

5617-1005

Molecular Formula

C17H15N5S (C17 H15 N5 S)

Compound Name

3-[(2E)-2-{[4-(methylsulfanyl)phenyl]methylidene}hydrazin-1-yl]-5-phenyl-1,2,4-triazine

IUPAC name

3-[(2E)-2-{[4-(methylsulfanyl)phenyl]methylidene}hydrazin-1-yl]-5-phenyl-124-triazine

SMILES

CSc1ccc(/C=N/Nc2nncc(-c3ccccc3)n2)cc1

InChI

InChI=1S/C17H15N5S/c1-23-15-9-7-13(8-10-15)11-18-21-17-20-16(12-19-22-17)14-5-3-2-4-6-14/h2-12H,1H3,(H,20,21,22)

InChI Key

MGXUAKJBGUFRDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02377873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.218

Distribution Coefficient, logD

4.218

Water Solubility, LogSw

-4.19

Polar Surface Area

54.866

Acid Dissociation Constant (pKa)

14.14

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

References: we are preparing a list of scientific research reports with 5617-1005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5617-1005?
Check Price and Availability of 5617-1005, 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 5617-1005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5617-1005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5617-1005
  • 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 5617-1005 available by request