D062-0810 Screening compound: 5-chloro-N-[(furan-2-yl)methyl]-3,6-dimethyl-N-[(4-methylphenyl)methyl]-1-benzofuran-2-carboxamide

D062-0810 Screening compound: 5-chloro-N-[(furan-2-yl)methyl]-3,6-dimethyl-N-[(4-methylphenyl)methyl]-1-benzofuran-2-carboxamide
D062-0810 Screening compound: 5-chloro-N-[(furan-2-yl)methyl]-3,6-dimethyl-N-[(4-methylphenyl)methyl]-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D062-0810
5-chloro-N-[(furan-2-yl)methyl]-3,6-dimethyl-N-[(4-methylphenyl)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

D062-0810

Molecular Formula

C24H22ClNO3 (C24 H22 ClNO3)

Compound Name

5-chloro-N-[(furan-2-yl)methyl]-3,6-dimethyl-N-[(4-methylphenyl)methyl]-1-benzofuran-2-carboxamide

IUPAC name

5-chloro-N-[(furan-2-yl)methyl]-36-dimethyl-N-[(4-methylphenyl)methyl]-1-benzofuran-2-carboxamide

SMILES

Cc(c1c2)c(C(N(Cc3ccco3)Cc3ccc(C)cc3)=O)oc1cc(C)c2Cl

InChI

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

InChI Key

KCBBZKPRORYOCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06649158

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

6.724

Distribution Coefficient, logD

6.724

Water Solubility, LogSw

-6.37

Polar Surface Area

32.453

Acid Dissociation Constant (pKa)

27.32

Base Dissociation Constant (pKb)

-2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

D062-0810 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with D062-0810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D062-0810?
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What is the minimum amount of D062-0810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D062-0810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D062-0810
  • 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 D062-0810 available by request