C201-1852 Screening compound: 6-[4-(2-ethoxyphenyl)piperazin-1-yl]-2,3-dihydropyridazine-3-thione

C201-1852 Screening compound: 6-[4-(2-ethoxyphenyl)piperazin-1-yl]-2,3-dihydropyridazine-3-thione
C201-1852 Screening compound: 6-[4-(2-ethoxyphenyl)piperazin-1-yl]-2,3-dihydropyridazine-3-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-1852
6-[4-(2-ethoxyphenyl)piperazin-1-yl]-2,3-dihydropyridazine-3-thione

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

C201-1852

Molecular Formula

C16H20N4OS (C16 H20 N4 OS)

Compound Name

6-[4-(2-ethoxyphenyl)piperazin-1-yl]-2,3-dihydropyridazine-3-thione

IUPAC name

6-[4-(2-ethoxyphenyl)piperazin-1-yl]-23-dihydropyridazine-3-thione

SMILES

CCOc(cccc1)c1N(CC1)CCN1C(C=C1)=NNC1=S

InChI

InChI=1S/C16H20N4OS/c1-2-21-14-6-4-3-5-13(14)19-9-11-20(12-10-19)15-7-8-16(22)18-17-15/h3-8H,2,9-12H2,1H3,(H,18,22)

InChI Key

BRWOABUHTXXAQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729822

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.005

Distribution Coefficient, logD

2.871

Water Solubility, LogSw

-3.32

Polar Surface Area

37.938

Acid Dissociation Constant (pKa)

7.84

Base Dissociation Constant (pKb)

5.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

C201-1852 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

KRAS-Targeted Library (16000 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C201-1852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-1852?
Check Price and Availability of C201-1852, 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 C201-1852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-1852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-1852
  • 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 C201-1852 available by request