L879-0004 Screening compound: N-{[(1H-1,3-benzodiazol-2-yl)carbamoyl]methyl}-2-(4-methylphenyl)acetamide

L879-0004 Screening compound: N-{[(1H-1,3-benzodiazol-2-yl)carbamoyl]methyl}-2-(4-methylphenyl)acetamide
L879-0004 Screening compound: N-{[(1H-1,3-benzodiazol-2-yl)carbamoyl]methyl}-2-(4-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L879-0004
N-{[(1H-1,3-benzodiazol-2-yl)carbamoyl]methyl}-2-(4-methylphenyl)acetamide

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

L879-0004

Molecular Formula

C18H18N4O2 (C18 H18 N4 O2)

Compound Name

N-{[(1H-1,3-benzodiazol-2-yl)carbamoyl]methyl}-2-(4-methylphenyl)acetamide

IUPAC name

N-{[(1H-13-benzodiazol-2-yl)carbamoyl]methyl}-2-(4-methylphenyl)acetamide

SMILES

Cc1ccc(CC(NCC(Nc2nc(cccc3)c3[nH]2)=O)=O)cc1

InChI

InChI=1S/C18H18N4O2/c1-12-6-8-13(9-7-12)10-16(23)19-11-17(24)22-18-20-14-4-2-3-5-15(14)21-18/h2-9H,10-11H2,1H3,(H,19,23)(H2,20,21,22,24)

InChI Key

SRCOETUIHVKJHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27483829

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.289

Distribution Coefficient, logD

2.289

Water Solubility, LogSw

-2.76

Polar Surface Area

68.013

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

2.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

L879-0004 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Targeted Diversity Library (40567 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

References: we are preparing a list of scientific research reports with L879-0004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L879-0004?
Check Price and Availability of L879-0004, 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 L879-0004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L879-0004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L879-0004
  • 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 L879-0004 available by request