P124-1472 Screening compound: 7-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-2-phenyl-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one

P124-1472 Screening compound: 7-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-2-phenyl-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one
P124-1472 Screening compound: 7-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-2-phenyl-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P124-1472
7-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-2-phenyl-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

P124-1472

Molecular Formula

C20H22N4O2S (C20 H22 N4 O2 S)

Compound Name

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

IUPAC name

7-methyl-5-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-2-phenyl-4H5H-[13]thiazolo[45-d]pyridazin-4-one

SMILES

CC(CCC1)CN1C(CN(C1=O)N=C(C)c2c1nc(-c1ccccc1)s2)=O

InChI

InChI=1S/C20H22N4O2S/c1-13-7-6-10-23(11-13)16(25)12-24-20(26)17-18(14(2)22-24)27-19(21-17)15-8-4-3-5-9-15/h3-5,8-9,13H,6-7,10-12H2,1-2H3/t13-/m0/s1

InChI Key

QBZOIABEZNQVMZ-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27643763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.49

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

3.263

Distribution Coefficient, logD

3.263

Water Solubility, LogSw

-3.27

Polar Surface Area

53.561

Acid Dissociation Constant (pKa)

17.72

Base Dissociation Constant (pKb)

0.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

P124-1472 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P124-1472 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P124-1472?
Check Price and Availability of P124-1472, 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 P124-1472 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P124-1472
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P124-1472
  • 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 P124-1472 available by request