2325-2089 Screening compound: N-(8-methoxy-2-oxo-2H-chromen-3-yl)-4-nitrobenzamide

2325-2089 Screening compound: N-(8-methoxy-2-oxo-2H-chromen-3-yl)-4-nitrobenzamide
2325-2089 Screening compound: N-(8-methoxy-2-oxo-2H-chromen-3-yl)-4-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2325-2089
N-(8-methoxy-2-oxo-2H-chromen-3-yl)-4-nitrobenzamide

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

2325-2089

Molecular Formula

C17H12N2O6 (C17 H12 N2 O6)

Compound Name

N-(8-methoxy-2-oxo-2H-chromen-3-yl)-4-nitrobenzamide

IUPAC name

N-(8-methoxy-2-oxo-2H-chromen-3-yl)-4-nitrobenzamide

SMILES

COc1cccc(C=C2NC(c(cc3)ccc3[N+]([O-])=O)=O)c1OC2=O

InChI

InChI=1S/C17H12N2O6/c1-24-14-4-2-3-11-9-13(17(21)25-15(11)14)18-16(20)10-5-7-12(8-6-10)19(22)23/h2-9H,1H3,(H,18,20)

InChI Key

IVMCUNLBEVIWFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01533327

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.29

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.576

Distribution Coefficient, logD

2.573

Water Solubility, LogSw

-3.10

Polar Surface Area

85.911

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

1.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

References: we are preparing a list of scientific research reports with 2325-2089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2325-2089?
Check Price and Availability of 2325-2089, 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 2325-2089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2325-2089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2325-2089
  • 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 2325-2089 available by request