Y043-1693 Screening compound: 2-[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]-N~1~-[4-(2-pyridyl)-1,3-thiazol-2-yl]acetamide

Y043-1693 Screening compound: 2-[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]-N~1~-[4-(2-pyridyl)-1,3-thiazol-2-yl]acetamide
Y043-1693 Screening compound: 2-[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]-N~1~-[4-(2-pyridyl)-1,3-thiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-1693
2-[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]-N~1~-[4-(2-pyridyl)-1,3-thiazol-2-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

Y043-1693

Molecular Formula

C21H16FN5O3S (C21 H16 FN5 O3 S)

Compound Name

2-[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]-N~1~-[4-(2-pyridyl)-1,3-thiazol-2-yl]acetamide

IUPAC name

2-[3-(2-fluoro-4-methoxyphenyl)-6-oxo-16-dihydropyridazin-1-yl]-N-[4-(pyridin-2-yl)-13-thiazol-2-yl]acetamide

SMILES

COc(cc1)cc(F)c1C(C=C1)=NN(CC(Nc2nc(-c3ncccc3)cs2)=O)C1=O

InChI

InChI=1S/C21H16FN5O3S/c1-30-13-5-6-14(15(22)10-13)16-7-8-20(29)27(26-16)11-19(28)25-21-24-18(12-31-21)17-4-2-3-9-23-17/h2-10,12H,11H2,1H3,(H,24,25,28)

InChI Key

LIYQWCCJOULOSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18798045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.526

Distribution Coefficient, logD

3.526

Water Solubility, LogSw

-3.92

Polar Surface Area

78.063

Acid Dissociation Constant (pKa)

11.71

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.52

Y043-1693 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 Y043-1693 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-1693?
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What is the minimum amount of Y043-1693 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-1693
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-1693
  • 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 Y043-1693 available by request