L008-0040 Screening compound: 3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-6-(pyrrolidin-1-yl)pyridazine

L008-0040 Screening compound: 3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-6-(pyrrolidin-1-yl)pyridazine
L008-0040 Screening compound: 3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-6-(pyrrolidin-1-yl)pyridazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L008-0040
3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-6-(pyrrolidin-1-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

L008-0040

Molecular Formula

C26H29N5O (C26 H29 N5 O)

Compound Name

3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-6-(pyrrolidin-1-yl)pyridazine

IUPAC name

3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-6-(pyrrolidin-1-yl)pyridazine

SMILES

O=C(c(cc1)ccc1-c(cc1)nnc1N1CCCC1)N1CCN(Cc2ccccc2)CC1

InChI

InChI=1S/C26H29N5O/c32-26(31-18-16-29(17-19-31)20-21-6-2-1-3-7-21)23-10-8-22(9-11-23)24-12-13-25(28-27-24)30-14-4-5-15-30/h1-3,6-13H,4-5,14-20H2

InChI Key

SSMBCUUWDGURLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27225891

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.408

Distribution Coefficient, logD

3.393

Water Solubility, LogSw

-3.40

Polar Surface Area

45.181

Acid Dissociation Constant (pKa)

23.38

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

L008-0040 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with L008-0040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L008-0040?
Check Price and Availability of L008-0040, 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 L008-0040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L008-0040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L008-0040
  • 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 L008-0040 available by request