6231-0017 Screening compound: (3E)-3-[(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazin-1-ylidene]-5-phenyl-4,5-dihydro-3H-pyrazole

6231-0017 Screening compound: (3E)-3-[(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazin-1-ylidene]-5-phenyl-4,5-dihydro-3H-pyrazole
6231-0017 Screening compound: (3E)-3-[(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazin-1-ylidene]-5-phenyl-4,5-dihydro-3H-pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6231-0017
(3E)-3-[(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazin-1-ylidene]-5-phenyl-4,5-dihydro-3H-pyrazole

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

6231-0017

Molecular Formula

C15H14N4S (C15 H14 N4 S)

Compound Name

(3E)-3-[(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazin-1-ylidene]-5-phenyl-4,5-dihydro-3H-pyrazole

IUPAC name

(3E)-3-[(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazin-1-ylidene]-5-phenyl-45-dihydro-3H-pyrazole

SMILES

Cc1ccc(/C=N/N=C(\C2)/N=NC2c2ccccc2)s1

InChI

InChI=1S/C15H14N4S/c1-11-7-8-13(20-11)10-16-18-15-9-14(17-19-15)12-5-3-2-4-6-12/h2-8,10,14H,9H2,1H3/t14-/m1/s1

InChI Key

IQMAKVNDUOXIDS-CQSZACIVSA-N

MDL Number (MFCD)

MFCD14711361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.256

Distribution Coefficient, logD

4.249

Water Solubility, LogSw

-4.28

Polar Surface Area

44.466

Acid Dissociation Constant (pKa)

21.03

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 6231-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6231-0017?
Check Price and Availability of 6231-0017, 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 6231-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6231-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6231-0017
  • 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 6231-0017 available by request