L748-0161 Screening compound: 1-(2-chloro-4-methylphenyl)-3-{2-[5-(piperidine-1-carbonyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea

L748-0161 Screening compound: 1-(2-chloro-4-methylphenyl)-3-{2-[5-(piperidine-1-carbonyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea
L748-0161 Screening compound: 1-(2-chloro-4-methylphenyl)-3-{2-[5-(piperidine-1-carbonyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L748-0161
1-(2-chloro-4-methylphenyl)-3-{2-[5-(piperidine-1-carbonyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea

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

L748-0161

Molecular Formula

C23H26ClN5O2 (C23 H26 ClN5 O2)

Compound Name

1-(2-chloro-4-methylphenyl)-3-{2-[5-(piperidine-1-carbonyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea

IUPAC name

1-(2-chloro-4-methylphenyl)-3-{2-[5-(piperidine-1-carbonyl)-1H-13-benzodiazol-1-yl]ethyl}urea

SMILES

Cc(cc1)cc(Cl)c1NC(NCCn1c(ccc(C(N2CCCCC2)=O)c2)c2nc1)=O

InChI

InChI=1S/C23H26ClN5O2/c1-16-5-7-19(18(24)13-16)27-23(31)25-9-12-29-15-26-20-14-17(6-8-21(20)29)22(30)28-10-3-2-4-11-28/h5-8,13-15H,2-4,9-12H2,1H3,(H2,25,27,31)

InChI Key

INSQVEBNPBBZLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27473774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.94

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.104

Distribution Coefficient, logD

3.102

Water Solubility, LogSw

-3.44

Polar Surface Area

60.090

Acid Dissociation Constant (pKa)

11.44

Base Dissociation Constant (pKb)

5.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

L748-0161 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Epigenetics Focused Set (26518 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L748-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L748-0161?
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What is the minimum amount of L748-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L748-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L748-0161
  • 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 L748-0161 available by request