L054-0302 Screening compound: 4-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazine-1-carbonyl]benzonitrile

L054-0302 Screening compound: 4-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazine-1-carbonyl]benzonitrile
L054-0302 Screening compound: 4-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazine-1-carbonyl]benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound L054-0302
4-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazine-1-carbonyl]benzonitrile

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

L054-0302

Molecular Formula

C26H23N5O (C26 H23 N5 O)

Compound Name

4-[4-(1-benzyl-1H-1,3-benzodiazol-2-yl)piperazine-1-carbonyl]benzonitrile

IUPAC name

4-[4-(1-benzyl-1H-13-benzodiazol-2-yl)piperazine-1-carbonyl]benzonitrile

SMILES

N#Cc(cc1)ccc1C(N(CC1)CCN1c1nc(cccc2)c2n1Cc1ccccc1)=O

InChI

InChI=1S/C26H23N5O/c27-18-20-10-12-22(13-11-20)25(32)29-14-16-30(17-15-29)26-28-23-8-4-5-9-24(23)31(26)19-21-6-2-1-3-7-21/h1-13H,14-17,19H2

InChI Key

RWKXVJAOUGLJAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15116981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.319

Distribution Coefficient, logD

4.286

Water Solubility, LogSw

-4.41

Polar Surface Area

46.673

Acid Dissociation Constant (pKa)

22.97

Base Dissociation Constant (pKb)

6.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

L054-0302 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L054-0302 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L054-0302?
Check Price and Availability of L054-0302, 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 L054-0302 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L054-0302
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L054-0302
  • 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 L054-0302 available by request