6066-1611 Screening compound: N-[2-(3-nitrophenyl)-5-oxo-5H-chromeno[4,3-d]pyrimidin-4-yl]acetamide

6066-1611 Screening compound: N-[2-(3-nitrophenyl)-5-oxo-5H-chromeno[4,3-d]pyrimidin-4-yl]acetamide
6066-1611 Screening compound: N-[2-(3-nitrophenyl)-5-oxo-5H-chromeno[4,3-d]pyrimidin-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6066-1611
N-[2-(3-nitrophenyl)-5-oxo-5H-chromeno[4,3-d]pyrimidin-4-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

6066-1611

Molecular Formula

C19H12N4O5 (C19 H12 N4 O5)

Compound Name

N-[2-(3-nitrophenyl)-5-oxo-5H-chromeno[4,3-d]pyrimidin-4-yl]acetamide

IUPAC name

N-[2-(3-nitrophenyl)-5-oxo-5H-chromeno[43-d]pyrimidin-4-yl]acetamide

SMILES

CC(Nc(nc(-c1cccc([N+]([O-])=O)c1)nc1-c(cccc2)c2O2)c1C2=O)=O

InChI

InChI=1S/C19H12N4O5/c1-10(24)20-18-15-16(13-7-2-3-8-14(13)28-19(15)25)21-17(22-18)11-5-4-6-12(9-11)23(26)27/h2-9H,1H3,(H,20,21,22,24)

InChI Key

AYOJZQNTJUWLAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01995877

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.33

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.360

Distribution Coefficient, logD

3.348

Water Solubility, LogSw

-4.03

Polar Surface Area

97.333

Acid Dissociation Constant (pKa)

8.94

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

6066-1611 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 6066-1611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6066-1611?
Check Price and Availability of 6066-1611, 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 6066-1611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6066-1611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6066-1611
  • 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 6066-1611 available by request