5941-1282 Screening compound: N-(1,2-dihydroacenaphthylen-5-yl)-2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetamide

5941-1282 Screening compound: N-(1,2-dihydroacenaphthylen-5-yl)-2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetamide
5941-1282 Screening compound: N-(1,2-dihydroacenaphthylen-5-yl)-2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5941-1282
N-(1,2-dihydroacenaphthylen-5-yl)-2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetamide

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

5941-1282

Molecular Formula

C21H16N2O3 (C21 H16 N2 O3)

Compound Name

N-(1,2-dihydroacenaphthylen-5-yl)-2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetamide

IUPAC name

N-(12-dihydroacenaphthylen-5-yl)-2-(2-oxo-23-dihydro-13-benzoxazol-3-yl)acetamide

SMILES

O=C(CN(c(cccc1)c1O1)C1=O)Nc1ccc(CC2)c3c2cccc13

InChI

InChI=1S/C21H16N2O3/c24-19(12-23-17-6-1-2-7-18(17)26-21(23)25)22-16-11-10-14-9-8-13-4-3-5-15(16)20(13)14/h1-7,10-11H,8-9,12H2,(H,22,24)

InChI Key

WRVITFDJHOAFAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03998722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.37

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

4.191

Distribution Coefficient, logD

4.191

Water Solubility, LogSw

-4.81

Polar Surface Area

45.534

Acid Dissociation Constant (pKa)

10.45

Base Dissociation Constant (pKb)

2.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

5941-1282 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 5941-1282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5941-1282?
Check Price and Availability of 5941-1282, 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 5941-1282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5941-1282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5941-1282
  • 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 5941-1282 available by request