G954-0485 Screening compound: 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazine

G954-0485 Screening compound: 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazine
G954-0485 Screening compound: 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G954-0485
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazine

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

G954-0485

Molecular Formula

C22H17ClFN3OS2 (C22 H17 ClFN3 OS2)

Compound Name

3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazine

IUPAC name

3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-[2-(4-methoxyphenyl)-4-methyl-13-thiazol-5-yl]pyridazine

SMILES

Cc1c(-c(cc2)nnc2SCc(c(F)ccc2)c2Cl)sc(-c(cc2)ccc2OC)n1

InChI

InChI=1S/C22H17ClFN3OS2/c1-13-21(30-22(25-13)14-6-8-15(28-2)9-7-14)19-10-11-20(27-26-19)29-12-16-17(23)4-3-5-18(16)24/h3-11H,12H2,1-2H3

InChI Key

TXBQJQZWBCYOIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09244673

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.98

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.272

Distribution Coefficient, logD

6.272

Water Solubility, LogSw

-6.33

Polar Surface Area

38.654

Acid Dissociation Constant (pKa)

25.68

Base Dissociation Constant (pKb)

1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with G954-0485 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G954-0485?
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What is the minimum amount of G954-0485 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G954-0485
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G954-0485
  • 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 G954-0485 available by request