L054-0197 Screening compound: 1-methyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]-1H-1,3-benzodiazole

L054-0197 Screening compound: 1-methyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]-1H-1,3-benzodiazole
L054-0197 Screening compound: 1-methyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound L054-0197
1-methyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]-1H-1,3-benzodiazole

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

L054-0197

Molecular Formula

C25H32N4O4 (C25 H32 N4 O4)

Compound Name

1-methyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]-1H-1,3-benzodiazole

IUPAC name

1-methyl-2-[4-(345-triethoxybenzoyl)piperazin-1-yl]-1H-13-benzodiazole

SMILES

CCOc1cc(C(N(CC2)CCN2c2nc(cccc3)c3n2C)=O)cc(OCC)c1OCC

InChI

InChI=1S/C25H32N4O4/c1-5-31-21-16-18(17-22(32-6-2)23(21)33-7-3)24(30)28-12-14-29(15-13-28)25-26-19-10-8-9-11-20(19)27(25)4/h8-11,16-17H,5-7,12-15H2,1-4H3

InChI Key

AEJDFWANGLYGKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15116968

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.541

Distribution Coefficient, logD

3.268

Water Solubility, LogSw

-3.59

Polar Surface Area

52.415

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

7.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

L054-0197 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L054-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L054-0197?
Check Price and Availability of L054-0197, 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 L054-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L054-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L054-0197
  • 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 L054-0197 available by request