C591-0096 Screening compound: 4-(6-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}pyridazin-3-yl)morpholine

C591-0096 Screening compound: 4-(6-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}pyridazin-3-yl)morpholine
C591-0096 Screening compound: 4-(6-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}pyridazin-3-yl)morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound C591-0096
4-(6-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}pyridazin-3-yl)morpholine

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

C591-0096

Molecular Formula

C25H34N6O3 (C25 H34 N6 O3)

Compound Name

4-(6-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}pyridazin-3-yl)morpholine

IUPAC name

4-(6-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}pyridazin-3-yl)morpholine

SMILES

COc(cc1)ccc1N(CC1)CCN1C(C(CC1)CCN1c(cc1)nnc1N1CCOCC1)=O

InChI

InChI=1S/C25H34N6O3/c1-33-22-4-2-21(3-5-22)28-12-14-31(15-13-28)25(32)20-8-10-29(11-9-20)23-6-7-24(27-26-23)30-16-18-34-19-17-30/h2-7,20H,8-19H2,1H3

InChI Key

XMGIXNLAPPOFLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14773288

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.730

Distribution Coefficient, logD

2.727

Water Solubility, LogSw

-2.77

Polar Surface Area

63.174

Acid Dissociation Constant (pKa)

22.96

Base Dissociation Constant (pKb)

7.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

C591-0096 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 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 C591-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C591-0096?
Check Price and Availability of C591-0096, 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 C591-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C591-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C591-0096
  • 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 C591-0096 available by request