D019-1002 Screening compound: (Z)-N-ethyl-N'-(3-phenyl-1H-pyrazol-5-yl)(methylsulfanyl)methanimidamide

D019-1002 Screening compound: (Z)-N-ethyl-N'-(3-phenyl-1H-pyrazol-5-yl)(methylsulfanyl)methanimidamide
D019-1002 Screening compound: (Z)-N-ethyl-N'-(3-phenyl-1H-pyrazol-5-yl)(methylsulfanyl)methanimidamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D019-1002
(Z)-N-ethyl-N'-(3-phenyl-1H-pyrazol-5-yl)(methylsulfanyl)methanimidamide

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

D019-1002

Molecular Formula

C13H16N4S (C13 H16 N4 S)

Compound Name

(Z)-N-ethyl-N'-(3-phenyl-1H-pyrazol-5-yl)(methylsulfanyl)methanimidamide

IUPAC name

(Z)-N-ethyl-N'-(3-phenyl-1H-pyrazol-5-yl)(methylsulfanyl)methanimidamide

SMILES

CCN/C(/SC)=N/c1cc(-c2ccccc2)n[nH]1

InChI

InChI=1S/C13H16N4S/c1-3-14-13(18-2)15-12-9-11(16-17-12)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H2,14,15,16,17)

InChI Key

NSONDFWINXCGPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14810879

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

260.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.008

Distribution Coefficient, logD

0.945

Water Solubility, LogSw

-3.12

Polar Surface Area

41.803

Acid Dissociation Constant (pKa)

13.11

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

D019-1002 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with D019-1002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D019-1002?
Check Price and Availability of D019-1002, 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 D019-1002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D019-1002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D019-1002
  • 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 D019-1002 available by request