L086-0329 Screening compound: N-[(E)-N'-(3,4-dimethylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl]-4-ethoxybenzamide

L086-0329 Screening compound: N-[(E)-N'-(3,4-dimethylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl]-4-ethoxybenzamide
L086-0329 Screening compound: N-[(E)-N'-(3,4-dimethylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl]-4-ethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L086-0329
N-[(E)-N'-(3,4-dimethylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl]-4-ethoxybenzamide

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

L086-0329

Molecular Formula

C24H26N4O2 (C24 H26 N4 O2)

Compound Name

N-[(E)-N'-(3,4-dimethylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl]-4-ethoxybenzamide

IUPAC name

N-[(E)-N'-(34-dimethylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl]-4-ethoxybenzamide

SMILES

CCOc(cc1)ccc1C(N/C(/NCc1ncccc1)=N/c1cc(C)c(C)cc1)=O

InChI

InChI=1S/C24H26N4O2/c1-4-30-22-12-9-19(10-13-22)23(29)28-24(26-16-21-7-5-6-14-25-21)27-20-11-8-17(2)18(3)15-20/h5-15H,4,16H2,1-3H3,(H2,26,27,28,29)

InChI Key

DCTWSUURIWNUJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27229925

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.614

Distribution Coefficient, logD

3.353

Water Solubility, LogSw

-4.23

Polar Surface Area

58.518

Acid Dissociation Constant (pKa)

11.85

Base Dissociation Constant (pKb)

8.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

L086-0329 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 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 L086-0329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L086-0329?
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What is the minimum amount of L086-0329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L086-0329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L086-0329
  • 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 L086-0329 available by request