D062-0743 Screening compound: N-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-3,6,7-trimethyl-1-benzofuran-2-carboxamide

D062-0743 Screening compound: N-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-3,6,7-trimethyl-1-benzofuran-2-carboxamide
D062-0743 Screening compound: N-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-3,6,7-trimethyl-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D062-0743
N-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-3,6,7-trimethyl-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

D062-0743

Molecular Formula

C24H22ClNO3 (C24 H22 ClNO3)

Compound Name

N-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-3,6,7-trimethyl-1-benzofuran-2-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-367-trimethyl-1-benzofuran-2-carboxamide

SMILES

Cc1c(C(N(Cc2ccco2)Cc(cccc2)c2Cl)=O)oc2c1ccc(C)c2C

InChI

InChI=1S/C24H22ClNO3/c1-15-10-11-20-17(3)23(29-22(20)16(15)2)24(27)26(14-19-8-6-12-28-19)13-18-7-4-5-9-21(18)25/h4-12H,13-14H2,1-3H3

InChI Key

QRZMTZZWVPSZBL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06646794

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.9

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.524

Distribution Coefficient, logD

6.524

Water Solubility, LogSw

-6.15

Polar Surface Area

32.686

Acid Dissociation Constant (pKa)

26.76

Base Dissociation Constant (pKb)

-4.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

D062-0743 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D062-0743 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D062-0743?
Check Price and Availability of D062-0743, 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 D062-0743 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D062-0743
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D062-0743
  • 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 D062-0743 available by request