P124-0594 Screening compound: N-[(2,5-dimethoxyphenyl)methyl]-2-{2-ethyl-7-methyl-4-oxo-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-5-yl}acetamide

P124-0594 Screening compound: N-[(2,5-dimethoxyphenyl)methyl]-2-{2-ethyl-7-methyl-4-oxo-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-5-yl}acetamide
P124-0594 Screening compound: N-[(2,5-dimethoxyphenyl)methyl]-2-{2-ethyl-7-methyl-4-oxo-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-5-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P124-0594
N-[(2,5-dimethoxyphenyl)methyl]-2-{2-ethyl-7-methyl-4-oxo-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-5-yl}acetamide

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

P124-0594

Molecular Formula

C19H22N4O4S (C19 H22 N4 O4 S)

Compound Name

N-[(2,5-dimethoxyphenyl)methyl]-2-{2-ethyl-7-methyl-4-oxo-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-5-yl}acetamide

IUPAC name

N-[(25-dimethoxyphenyl)methyl]-2-{2-ethyl-7-methyl-4-oxo-4H5H-[13]thiazolo[45-d]pyridazin-5-yl}acetamide

SMILES

CCc1nc(C(N(CC(NCc(cc(cc2)OC)c2OC)=O)N=C2C)=O)c2s1

InChI

InChI=1S/C19H22N4O4S/c1-5-16-21-17-18(28-16)11(2)22-23(19(17)25)10-15(24)20-9-12-8-13(26-3)6-7-14(12)27-4/h6-8H,5,9-10H2,1-4H3,(H,20,24)

InChI Key

KBMNGKAAGJSTAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27565841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.699

Distribution Coefficient, logD

2.699

Water Solubility, LogSw

-3.06

Polar Surface Area

77.648

Acid Dissociation Constant (pKa)

14.10

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with P124-0594 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P124-0594?
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What is the minimum amount of P124-0594 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P124-0594
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P124-0594
  • 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 P124-0594 available by request