D347-3695 Screening compound: N-methyl-N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}furan-2-carboxamide

D347-3695 Screening compound: N-methyl-N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}furan-2-carboxamide
D347-3695 Screening compound: N-methyl-N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-3695
N-methyl-N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}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

D347-3695

Molecular Formula

C17H17N3O2 (C17 H17 N3 O2)

Compound Name

N-methyl-N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}furan-2-carboxamide

IUPAC name

N-methyl-N-{[1-(prop-2-en-1-yl)-1H-13-benzodiazol-2-yl]methyl}furan-2-carboxamide

SMILES

CN(Cc1nc(cccc2)c2n1CC=C)C(c1ccco1)=O

InChI

InChI=1S/C17H17N3O2/c1-3-10-20-14-8-5-4-7-13(14)18-16(20)12-19(2)17(21)15-9-6-11-22-15/h3-9,11H,1,10,12H2,2H3

InChI Key

YTAPSTWEOPKKON-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09362308

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.546

Distribution Coefficient, logD

2.546

Water Solubility, LogSw

-2.46

Polar Surface Area

36.122

Acid Dissociation Constant (pKa)

26.42

Base Dissociation Constant (pKb)

2.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

D347-3695 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with D347-3695 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-3695?
Check Price and Availability of D347-3695, 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 D347-3695 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-3695
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-3695
  • 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 D347-3695 available by request