P124-0650 Screening compound: 2-ethyl-7-methyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one

P124-0650 Screening compound: 2-ethyl-7-methyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one
P124-0650 Screening compound: 2-ethyl-7-methyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P124-0650
2-ethyl-7-methyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one

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

P124-0650

Molecular Formula

C14H18N4O2S (C14 H18 N4 O2 S)

Compound Name

2-ethyl-7-methyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one

IUPAC name

2-ethyl-7-methyl-5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4H5H-[13]thiazolo[45-d]pyridazin-4-one

SMILES

CCc1nc(C(N(CC(N2CCCC2)=O)N=C2C)=O)c2s1

InChI

InChI=1S/C14H18N4O2S/c1-3-10-15-12-13(21-10)9(2)16-18(14(12)20)8-11(19)17-6-4-5-7-17/h3-8H2,1-2H3

InChI Key

AHYHGXGICXVCGR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27565860

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.652

Distribution Coefficient, logD

1.652

Water Solubility, LogSw

-1.81

Polar Surface Area

54.760

Acid Dissociation Constant (pKa)

17.72

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

P124-0650 in Drug Discovery

Included in Screening Libraries

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

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with P124-0650 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P124-0650?
Check Price and Availability of P124-0650, 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 P124-0650 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P124-0650
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P124-0650
  • 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 P124-0650 available by request