M099-2426 Screening compound: 3-(4-butylpiperazin-1-yl)-6-[5-(piperidine-1-sulfonyl)thiophen-3-yl]pyridazine

M099-2426 Screening compound: 3-(4-butylpiperazin-1-yl)-6-[5-(piperidine-1-sulfonyl)thiophen-3-yl]pyridazine
M099-2426 Screening compound: 3-(4-butylpiperazin-1-yl)-6-[5-(piperidine-1-sulfonyl)thiophen-3-yl]pyridazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M099-2426
3-(4-butylpiperazin-1-yl)-6-[5-(piperidine-1-sulfonyl)thiophen-3-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

M099-2426

Molecular Formula

C21H31N5O2S2 (C21 H31 N5 O2 S2)

Compound Name

3-(4-butylpiperazin-1-yl)-6-[5-(piperidine-1-sulfonyl)thiophen-3-yl]pyridazine

IUPAC name

3-(4-butylpiperazin-1-yl)-6-[5-(piperidine-1-sulfonyl)thiophen-3-yl]pyridazine

SMILES

CCCCN(CC1)CCN1c(cc1)nnc1-c1csc(S(N2CCCCC2)(=O)=O)c1

InChI

InChI=1S/C21H31N5O2S2/c1-2-3-9-24-12-14-25(15-13-24)20-8-7-19(22-23-20)18-16-21(29-17-18)30(27,28)26-10-5-4-6-11-26/h7-8,16-17H,2-6,9-15H2,1H3

InChI Key

NBRBVUABKOPPGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27496655

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.516

Distribution Coefficient, logD

2.848

Water Solubility, LogSw

-3.67

Polar Surface Area

61.145

Acid Dissociation Constant (pKa)

24.56

Base Dissociation Constant (pKb)

7.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

M099-2426 in Drug Discovery

Included in Screening Libraries

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

Regenerative Medicine Focused Library (23016 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with M099-2426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M099-2426?
Check Price and Availability of M099-2426, 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 M099-2426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M099-2426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M099-2426
  • 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 M099-2426 available by request