L054-0316 Screening compound: 1-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one

L054-0316 Screening compound: 1-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
L054-0316 Screening compound: 1-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L054-0316
1-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one

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

L054-0316

Molecular Formula

C27H28N4O2 (C27 H28 N4 O2)

Compound Name

1-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one

IUPAC name

1-[4-(1-benzyl-1H-13-benzodiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one

SMILES

COc1ccc(CC(N(CC2)CCN2c2nc(cccc3)c3n2Cc2ccccc2)=O)cc1

InChI

InChI=1S/C27H28N4O2/c1-33-23-13-11-21(12-14-23)19-26(32)29-15-17-30(18-16-29)27-28-24-9-5-6-10-25(24)31(27)20-22-7-3-2-4-8-22/h2-14H,15-20H2,1H3

InChI Key

ULCWFGRAFRRVCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15116987

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.927

Distribution Coefficient, logD

4.893

Water Solubility, LogSw

-4.68

Polar Surface Area

36.633

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

6.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

L054-0316 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Nucleic Acid Ligands (8311 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Proteases
  • Others

References: we are preparing a list of scientific research reports with L054-0316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L054-0316?
Check Price and Availability of L054-0316, 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 L054-0316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L054-0316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L054-0316
  • 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 L054-0316 available by request