M428-1480 Screening compound: ethyl 1-(6-{[(2-chlorophenyl)methyl]sulfanyl}pyridazin-3-yl)-5-methyl-1H-pyrazole-4-carboxylate

M428-1480 Screening compound: ethyl 1-(6-{[(2-chlorophenyl)methyl]sulfanyl}pyridazin-3-yl)-5-methyl-1H-pyrazole-4-carboxylate
M428-1480 Screening compound: ethyl 1-(6-{[(2-chlorophenyl)methyl]sulfanyl}pyridazin-3-yl)-5-methyl-1H-pyrazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound M428-1480
ethyl 1-(6-{[(2-chlorophenyl)methyl]sulfanyl}pyridazin-3-yl)-5-methyl-1H-pyrazole-4-carboxylate

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

M428-1480

Molecular Formula

C18H17ClN4O2S (C18 H17 ClN4 O2 S)

Compound Name

ethyl 1-(6-{[(2-chlorophenyl)methyl]sulfanyl}pyridazin-3-yl)-5-methyl-1H-pyrazole-4-carboxylate

IUPAC name

ethyl 1-(6-{[(2-chlorophenyl)methyl]sulfanyl}pyridazin-3-yl)-5-methyl-1H-pyrazole-4-carboxylate

SMILES

CCOC(c1c(C)n(-c(cc2)nnc2SCc(cccc2)c2Cl)nc1)=O

InChI

InChI=1S/C18H17ClN4O2S/c1-3-25-18(24)14-10-20-23(12(14)2)16-8-9-17(22-21-16)26-11-13-6-4-5-7-15(13)19/h4-10H,3,11H2,1-2H3

InChI Key

LBAHLKHMLLTGTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27541259

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.538

Distribution Coefficient, logD

4.538

Water Solubility, LogSw

-4.56

Polar Surface Area

55.353

Acid Dissociation Constant (pKa)

25.68

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

M428-1480 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M428-1480 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M428-1480?
Check Price and Availability of M428-1480, 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 M428-1480 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M428-1480
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M428-1480
  • 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 M428-1480 available by request