D062-0352 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-5-ethyl-N-[(furan-2-yl)methyl]-3-methyl-1-benzofuran-2-carboxamide

D062-0352 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-5-ethyl-N-[(furan-2-yl)methyl]-3-methyl-1-benzofuran-2-carboxamide
D062-0352 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-5-ethyl-N-[(furan-2-yl)methyl]-3-methyl-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D062-0352
N-{[4-(dimethylamino)phenyl]methyl}-5-ethyl-N-[(furan-2-yl)methyl]-3-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

D062-0352

Molecular Formula

C26H28N2O3 (C26 H28 N2 O3)

Compound Name

N-{[4-(dimethylamino)phenyl]methyl}-5-ethyl-N-[(furan-2-yl)methyl]-3-methyl-1-benzofuran-2-carboxamide

IUPAC name

N-{[4-(dimethylamino)phenyl]methyl}-5-ethyl-N-[(furan-2-yl)methyl]-3-methyl-1-benzofuran-2-carboxamide

SMILES

CCc(cc1)cc2c1oc(C(N(Cc1ccco1)Cc(cc1)ccc1N(C)C)=O)c2C

InChI

InChI=1S/C26H28N2O3/c1-5-19-10-13-24-23(15-19)18(2)25(31-24)26(29)28(17-22-7-6-14-30-22)16-20-8-11-21(12-9-20)27(3)4/h6-15H,5,16-17H2,1-4H3

InChI Key

ORZCGUXFYNRTHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06648750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.833

Distribution Coefficient, logD

5.818

Water Solubility, LogSw

-5.50

Polar Surface Area

35.257

Acid Dissociation Constant (pKa)

25.26

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

D062-0352 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D062-0352 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D062-0352?
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What is the minimum amount of D062-0352 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D062-0352
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D062-0352
  • 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 D062-0352 available by request