1655-0047 Screening compound: (5-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioyl)sulfanide

1655-0047 Screening compound: (5-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioyl)sulfanide
1655-0047 Screening compound: (5-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioyl)sulfanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1655-0047
(5-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioyl)sulfanide

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

1655-0047

Molecular Formula

C10H9N2S2 (C10 H9 N2 S2)

Compound Name

(5-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioyl)sulfanide

IUPAC name

(5-phenyl-45-dihydro-1H-pyrazole-1-carbothioyl)sulfanide

SMILES

[S-]C(N1N=CCC1c1ccccc1)=S

InChI

InChI=1S/C10H10N2S2/c13-10(14)12-9(6-7-11-12)8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,13,14)/p-1/t9-/m0/s1

InChI Key

ACEWBOIMCFVVKN-VIFPVBQESA-M

MDL Number (MFCD)

MFCD01532487

Chemical and Physical Properties

Saltdata

Na+

Molecular Weight

221.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.673

Distribution Coefficient, logD

2.673

Water Solubility, LogSw

-2.73

Polar Surface Area

14.153

Acid Dissociation Constant (pKa)

22.82

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

1655-0047 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 1655-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1655-0047?
Check Price and Availability of 1655-0047, 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 1655-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1655-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1655-0047
  • 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 1655-0047 available by request