D347-3594 Screening compound: N-(1-{1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-1,3-benzodiazol-2-yl}ethyl)furan-2-carboxamide

D347-3594 Screening compound: N-(1-{1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-1,3-benzodiazol-2-yl}ethyl)furan-2-carboxamide
D347-3594 Screening compound: N-(1-{1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-1,3-benzodiazol-2-yl}ethyl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-3594
N-(1-{1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-1,3-benzodiazol-2-yl}ethyl)furan-2-carboxamide

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

D347-3594

Molecular Formula

C21H24N4O3 (C21 H24 N4 O3)

Compound Name

N-(1-{1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-1,3-benzodiazol-2-yl}ethyl)furan-2-carboxamide

IUPAC name

N-(1-{1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-13-benzodiazol-2-yl}ethyl)furan-2-carboxamide

SMILES

CC(c1nc(cccc2)c2n1CC(N1CCCCC1)=O)NC(c1ccco1)=O

InChI

InChI=1S/C21H24N4O3/c1-15(22-21(27)18-10-7-13-28-18)20-23-16-8-3-4-9-17(16)25(20)14-19(26)24-11-5-2-6-12-24/h3-4,7-10,13,15H,2,5-6,11-12,14H2,1H3,(H,22,27)/t15-/m0/s1

InChI Key

XWDPANWUCVHCRY-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD09983344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.381

Distribution Coefficient, logD

2.378

Water Solubility, LogSw

-2.67

Polar Surface Area

58.714

Acid Dissociation Constant (pKa)

10.90

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

D347-3594 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with D347-3594 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-3594?
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What is the minimum amount of D347-3594 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-3594
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-3594
  • 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 D347-3594 available by request