2512-1552 Screening compound: N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide

2512-1552 Screening compound: N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide
2512-1552 Screening compound: N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2512-1552
N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-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

2512-1552

Molecular Formula

C19H14N2O5 (C19 H14 N2 O5)

Compound Name

N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide

IUPAC name

N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide

SMILES

C=CCc1cccc(C=C2C(Nc(cc3)ccc3[N+]([O-])=O)=O)c1OC2=O

InChI

InChI=1S/C19H14N2O5/c1-2-4-12-5-3-6-13-11-16(19(23)26-17(12)13)18(22)20-14-7-9-15(10-8-14)21(24)25/h2-3,5-11H,1,4H2,(H,20,22)

InChI Key

KICWUFCOQSEIFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01077523

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.33

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.917

Distribution Coefficient, logD

3.351

Water Solubility, LogSw

-4.36

Polar Surface Area

77.317

Acid Dissociation Constant (pKa)

6.97

Base Dissociation Constant (pKb)

-3.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

2512-1552 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 2512-1552 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2512-1552?
Check Price and Availability of 2512-1552, 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 2512-1552 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2512-1552
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2512-1552
  • 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 2512-1552 available by request