3379-3448 Screening compound: N-{[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl}-1-benzofuran-2-carboxamide

3379-3448 Screening compound: N-{[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl}-1-benzofuran-2-carboxamide
3379-3448 Screening compound: N-{[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl}-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3379-3448
N-{[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl}-1-benzofuran-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

3379-3448

Molecular Formula

C23H25NO4 (C23 H25 NO4)

Compound Name

N-{[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl}-1-benzofuran-2-carboxamide

IUPAC name

N-{[1-(34-dimethoxyphenyl)cyclopentyl]methyl}-1-benzofuran-2-carboxamide

SMILES

COc(ccc(C1(CNC(c2cc(cccc3)c3o2)=O)CCCC1)c1)c1OC

InChI

InChI=1S/C23H25NO4/c1-26-19-10-9-17(14-20(19)27-2)23(11-5-6-12-23)15-24-22(25)21-13-16-7-3-4-8-18(16)28-21/h3-4,7-10,13-14H,5-6,11-12,15H2,1-2H3,(H,24,25)

InChI Key

CPVKTQCNZORDDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01897663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.698

Distribution Coefficient, logD

4.698

Water Solubility, LogSw

-5.20

Polar Surface Area

48.492

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

-0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

3379-3448 in Drug Discovery

Included in Screening Libraries

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 3379-3448 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3379-3448?
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What is the minimum amount of 3379-3448 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3379-3448
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3379-3448
  • 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 3379-3448 available by request