G954-0238 Screening compound: 3-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]-6-{[(pyridin-4-yl)methyl]sulfanyl}pyridazine

G954-0238 Screening compound: 3-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]-6-{[(pyridin-4-yl)methyl]sulfanyl}pyridazine
G954-0238 Screening compound: 3-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]-6-{[(pyridin-4-yl)methyl]sulfanyl}pyridazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G954-0238
3-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]-6-{[(pyridin-4-yl)methyl]sulfanyl}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

G954-0238

Molecular Formula

C18H14N4S3 (C18 H14 N4 S3)

Compound Name

3-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]-6-{[(pyridin-4-yl)methyl]sulfanyl}pyridazine

IUPAC name

3-[4-methyl-2-(thiophen-2-yl)-13-thiazol-5-yl]-6-{[(pyridin-4-yl)methyl]sulfanyl}pyridazine

SMILES

Cc1c(-c(cc2)nnc2SCc2ccncc2)sc(-c2cccs2)n1

InChI

InChI=1S/C18H14N4S3/c1-12-17(25-18(20-12)15-3-2-10-23-15)14-4-5-16(22-21-14)24-11-13-6-8-19-9-7-13/h2-10H,11H2,1H3

InChI Key

QIFPNXNGIJWZFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08533560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.758

Distribution Coefficient, logD

3.754

Water Solubility, LogSw

-3.83

Polar Surface Area

41.557

Acid Dissociation Constant (pKa)

26.50

Base Dissociation Constant (pKb)

5.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

G954-0238 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 G954-0238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G954-0238?
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What is the minimum amount of G954-0238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G954-0238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G954-0238
  • 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 G954-0238 available by request