L493-0376 Screening compound: methyl 4-(4-methylpiperazin-1-yl)-3-(2-phenoxyacetamido)benzoate

L493-0376 Screening compound: methyl 4-(4-methylpiperazin-1-yl)-3-(2-phenoxyacetamido)benzoate
L493-0376 Screening compound: methyl 4-(4-methylpiperazin-1-yl)-3-(2-phenoxyacetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L493-0376
methyl 4-(4-methylpiperazin-1-yl)-3-(2-phenoxyacetamido)benzoate

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

L493-0376

Molecular Formula

C21H25N3O4 (C21 H25 N3 O4)

Compound Name

methyl 4-(4-methylpiperazin-1-yl)-3-(2-phenoxyacetamido)benzoate

IUPAC name

methyl 4-(4-methylpiperazin-1-yl)-3-(2-phenoxyacetamido)benzoate

SMILES

CN(CC1)CCN1c(ccc(C(OC)=O)c1)c1NC(COc1ccccc1)=O

InChI

InChI=1S/C21H25N3O4/c1-23-10-12-24(13-11-23)19-9-8-16(21(26)27-2)14-18(19)22-20(25)15-28-17-6-4-3-5-7-17/h3-9,14H,10-13,15H2,1-2H3,(H,22,25)

InChI Key

NEVBKKGWNCUWMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07177167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.993

Distribution Coefficient, logD

2.518

Water Solubility, LogSw

-3.49

Polar Surface Area

57.720

Acid Dissociation Constant (pKa)

9.24

Base Dissociation Constant (pKb)

7.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L493-0376 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
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 L493-0376 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L493-0376?
Check Price and Availability of L493-0376, 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 L493-0376 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L493-0376
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L493-0376
  • 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 L493-0376 available by request