2360-0145 Screening compound: 4-(2-chloro-5-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione

2360-0145 Screening compound: 4-(2-chloro-5-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
2360-0145 Screening compound: 4-(2-chloro-5-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2360-0145
4-(2-chloro-5-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione

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

2360-0145

Molecular Formula

C14H9ClN2O5 (C14 H9 ClN2 O5)

Compound Name

4-(2-chloro-5-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione

IUPAC name

4-(2-chloro-5-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0^{26}]dec-8-ene-35-dione

SMILES

[O-][N+](c(cc1)cc(N(C(C(C23)C4OC3C=C4)=O)C2=O)c1Cl)=O

InChI

InChI=1S/C14H9ClN2O5/c15-7-2-1-6(17(20)21)5-8(7)16-13(18)11-9-3-4-10(22-9)12(11)14(16)19/h1-5,9-12H

InChI Key

WDHWVBYYVWBZGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01053520

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.69

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.418

Distribution Coefficient, logD

1.418

Water Solubility, LogSw

-2.56

Polar Surface Area

70.585

Acid Dissociation Constant (pKa)

16.78

Base Dissociation Constant (pKb)

-8.93

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

28.60

2360-0145 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2360-0145 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2360-0145?
Check Price and Availability of 2360-0145, 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 2360-0145 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2360-0145
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2360-0145
  • 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 2360-0145 available by request