L155-0155 Screening compound: 2-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)-4-methylpyrimidine

L155-0155 Screening compound: 2-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)-4-methylpyrimidine
L155-0155 Screening compound: 2-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)-4-methylpyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound L155-0155
2-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)-4-methylpyrimidine

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

L155-0155

Molecular Formula

C23H29N5O3 (C23 H29 N5 O3)

Compound Name

2-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)-4-methylpyrimidine

IUPAC name

2-(4-{4-[(2H-13-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)-4-methylpyrimidine

SMILES

Cc1ccnc(N(CC2)CCC2C(N2CCN(Cc(cc3)cc4c3OCO4)CC2)=O)n1

InChI

InChI=1S/C23H29N5O3/c1-17-4-7-24-23(25-17)28-8-5-19(6-9-28)22(29)27-12-10-26(11-13-27)15-18-2-3-20-21(14-18)31-16-30-20/h2-4,7,14,19H,5-6,8-13,15-16H2,1H3

InChI Key

DGWPDPDTLGKTTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27234984

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.306

Distribution Coefficient, logD

1.838

Water Solubility, LogSw

-2.70

Polar Surface Area

58.732

Acid Dissociation Constant (pKa)

19.29

Base Dissociation Constant (pKb)

7.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

L155-0155 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with L155-0155 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L155-0155?
Check Price and Availability of L155-0155, 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 L155-0155 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L155-0155
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L155-0155
  • 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 L155-0155 available by request