L087-0346 Screening compound: N-[(E)-N'-(5-chloro-2-methoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl]-4-fluorobenzamide

L087-0346 Screening compound: N-[(E)-N'-(5-chloro-2-methoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl]-4-fluorobenzamide
L087-0346 Screening compound: N-[(E)-N'-(5-chloro-2-methoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl]-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L087-0346
N-[(E)-N'-(5-chloro-2-methoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl]-4-fluorobenzamide

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

L087-0346

Molecular Formula

C21H18ClFN4O2 (C21 H18 ClFN4 O2)

Compound Name

N-[(E)-N'-(5-chloro-2-methoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl]-4-fluorobenzamide

IUPAC name

N-[(E)-N'-(5-chloro-2-methoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl]-4-fluorobenzamide

SMILES

COc(ccc(Cl)c1)c1/N=C(\NCc1cnccc1)/NC(c(cc1)ccc1F)=O

InChI

InChI=1S/C21H18ClFN4O2/c1-29-19-9-6-16(22)11-18(19)26-21(25-13-14-3-2-10-24-12-14)27-20(28)15-4-7-17(23)8-5-15/h2-12H,13H2,1H3,(H2,25,26,27,28)

InChI Key

SJKZXJWRRYZARM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27230370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.115

Distribution Coefficient, logD

3.099

Water Solubility, LogSw

-3.59

Polar Surface Area

58.302

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

5.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

L087-0346 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with L087-0346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L087-0346?
Check Price and Availability of L087-0346, 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 L087-0346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L087-0346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L087-0346
  • 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 L087-0346 available by request