3448-2376 Screening compound: 4-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-N~1~-phenylbenzamide

3448-2376 Screening compound: 4-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-N~1~-phenylbenzamide
3448-2376 Screening compound: 4-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-N~1~-phenylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3448-2376
4-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-N~1~-phenylbenzamide

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

3448-2376

Molecular Formula

C22H18N2O3 (C22 H18 N2 O3)

Compound Name

4-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-N~1~-phenylbenzamide

IUPAC name

4-{35-dioxo-4-azatricyclo[5.2.1.0^{26}]dec-8-en-4-yl}-N-phenylbenzamide

SMILES

O=C(c(cc1)ccc1N(C(C1C2C3C=CC1C3)=O)C2=O)Nc1ccccc1

InChI

InChI=1S/C22H18N2O3/c25-20(23-16-4-2-1-3-5-16)13-8-10-17(11-9-13)24-21(26)18-14-6-7-15(12-14)19(18)22(24)27/h1-11,14-15,18-19H,12H2,(H,23,25)

InChI Key

VLVGQOXLFOCCMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01884370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.242

Distribution Coefficient, logD

2.242

Water Solubility, LogSw

-2.79

Polar Surface Area

52.816

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

22.70

3448-2376 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with 3448-2376 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3448-2376?
Check Price and Availability of 3448-2376, 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 3448-2376 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3448-2376
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3448-2376
  • 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 3448-2376 available by request