L285-0448 Screening compound: ethyl 1-{6-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]pyridazin-3-yl}piperidine-4-carboxylate

L285-0448 Screening compound: ethyl 1-{6-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]pyridazin-3-yl}piperidine-4-carboxylate
L285-0448 Screening compound: ethyl 1-{6-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]pyridazin-3-yl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L285-0448
ethyl 1-{6-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]pyridazin-3-yl}piperidine-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

L285-0448

Molecular Formula

C23H30N4O4S (C23 H30 N4 O4 S)

Compound Name

ethyl 1-{6-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]pyridazin-3-yl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{6-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]pyridazin-3-yl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1c(cc1)nnc1-c1cc(S(N2CCCC2)(=O)=O)c(C)cc1)=O

InChI

InChI=1S/C23H30N4O4S/c1-3-31-23(28)18-10-14-26(15-11-18)22-9-8-20(24-25-22)19-7-6-17(2)21(16-19)32(29,30)27-12-4-5-13-27/h6-9,16,18H,3-5,10-15H2,1-2H3

InChI Key

KSDXCIAUFOKAHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27240105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.692

Distribution Coefficient, logD

3.691

Water Solubility, LogSw

-3.76

Polar Surface Area

77.456

Acid Dissociation Constant (pKa)

22.84

Base Dissociation Constant (pKb)

4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.17

L285-0448 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L285-0448 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L285-0448?
Check Price and Availability of L285-0448, 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 L285-0448 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L285-0448
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L285-0448
  • 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 L285-0448 available by request