3763-2021 Screening compound: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-1-benzofuran-2-carboxamide

3763-2021 Screening compound: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-1-benzofuran-2-carboxamide
3763-2021 Screening compound: N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3763-2021
N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-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

3763-2021

Molecular Formula

C24H18N2O3 (C24 H18 N2 O3)

Compound Name

N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-1-benzofuran-2-carboxamide

IUPAC name

N-[4-(56-dimethyl-13-benzoxazol-2-yl)phenyl]-1-benzofuran-2-carboxamide

SMILES

Cc(c(C)c1)cc2c1oc(-c(cc1)ccc1NC(c1cc(cccc3)c3o1)=O)n2

InChI

InChI=1S/C24H18N2O3/c1-14-11-19-21(12-15(14)2)29-24(26-19)16-7-9-18(10-8-16)25-23(27)22-13-17-5-3-4-6-20(17)28-22/h3-13H,1-2H3,(H,25,27)

InChI Key

XLMBOEFZDNYTEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02210700

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.293

Distribution Coefficient, logD

6.293

Water Solubility, LogSw

-6.28

Polar Surface Area

48.433

Acid Dissociation Constant (pKa)

11.90

Base Dissociation Constant (pKb)

-0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

3763-2021 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 3763-2021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3763-2021?
Check Price and Availability of 3763-2021, 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 3763-2021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3763-2021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3763-2021
  • 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 3763-2021 available by request