D340-0547 Screening compound: N5-[2-(1H-indol-3-yl)ethyl]-N4-[(2-methoxyphenyl)methyl]-1H-imidazole-4,5-dicarboxamide

D340-0547 Screening compound: N5-[2-(1H-indol-3-yl)ethyl]-N4-[(2-methoxyphenyl)methyl]-1H-imidazole-4,5-dicarboxamide
D340-0547 Screening compound: N5-[2-(1H-indol-3-yl)ethyl]-N4-[(2-methoxyphenyl)methyl]-1H-imidazole-4,5-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D340-0547
N5-[2-(1H-indol-3-yl)ethyl]-N4-[(2-methoxyphenyl)methyl]-1H-imidazole-4,5-dicarboxamide

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

D340-0547

Molecular Formula

C23H23N5O3 (C23 H23 N5 O3)

Compound Name

N5-[2-(1H-indol-3-yl)ethyl]-N4-[(2-methoxyphenyl)methyl]-1H-imidazole-4,5-dicarboxamide

IUPAC name

N5-[2-(1H-indol-3-yl)ethyl]-N4-[(2-methoxyphenyl)methyl]-1H-imidazole-45-dicarboxamide

SMILES

COc1c(CNC(c2c(C(NCCc3c[nH]c4c3cccc4)=O)[nH]cn2)=O)cccc1

InChI

InChI=1S/C23H23N5O3/c1-31-19-9-5-2-6-16(19)13-26-23(30)21-20(27-14-28-21)22(29)24-11-10-15-12-25-18-8-4-3-7-17(15)18/h2-9,12,14,25H,10-11,13H2,1H3,(H,24,29)(H,26,30)(H,27,28)

InChI Key

PMLMIZGFCKADBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820546

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.374

Distribution Coefficient, logD

2.363

Water Solubility, LogSw

-2.65

Polar Surface Area

88.777

Acid Dissociation Constant (pKa)

8.97

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

D340-0547 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Proteases
  • Phosphatases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D340-0547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D340-0547?
Check Price and Availability of D340-0547, 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 D340-0547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D340-0547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D340-0547
  • 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 D340-0547 available by request