P124-0652 Screening compound: 2-ethyl-7-methyl-5-[2-(morpholin-4-yl)-2-oxoethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one

P124-0652 Screening compound: 2-ethyl-7-methyl-5-[2-(morpholin-4-yl)-2-oxoethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one
P124-0652 Screening compound: 2-ethyl-7-methyl-5-[2-(morpholin-4-yl)-2-oxoethyl]-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P124-0652
2-ethyl-7-methyl-5-[2-(morpholin-4-yl)-2-oxoethyl]-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

P124-0652

Molecular Formula

C14H18N4O3S (C14 H18 N4 O3 S)

Compound Name

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

IUPAC name

2-ethyl-7-methyl-5-[2-(morpholin-4-yl)-2-oxoethyl]-4H5H-[13]thiazolo[45-d]pyridazin-4-one

SMILES

CCc1nc(C(N(CC(N2CCOCC2)=O)N=C2C)=O)c2s1

InChI

InChI=1S/C14H18N4O3S/c1-3-10-15-12-13(22-10)9(2)16-18(14(12)20)8-11(19)17-4-6-21-7-5-17/h3-8H2,1-2H3

InChI Key

DOVIYMYNJOUSRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27565862

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.712

Distribution Coefficient, logD

0.712

Water Solubility, LogSw

-1.19

Polar Surface Area

62.303

Acid Dissociation Constant (pKa)

17.72

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

P124-0652 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P124-0652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P124-0652?
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What is the minimum amount of P124-0652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P124-0652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P124-0652
  • 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 P124-0652 available by request