F306-0059 Screening compound: 2-chloro-N-(4-{2-methyl-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-3-yl}phenyl)-5-nitrobenzamide

F306-0059 Screening compound: 2-chloro-N-(4-{2-methyl-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-3-yl}phenyl)-5-nitrobenzamide
F306-0059 Screening compound: 2-chloro-N-(4-{2-methyl-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-3-yl}phenyl)-5-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F306-0059
2-chloro-N-(4-{2-methyl-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-3-yl}phenyl)-5-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

F306-0059

Molecular Formula

C21H14ClN5O4 (C21 H14 ClN5 O4)

Compound Name

2-chloro-N-(4-{2-methyl-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-3-yl}phenyl)-5-nitrobenzamide

IUPAC name

2-chloro-N-(4-{2-methyl-4-oxo-3H4H-pyrido[23-d]pyrimidin-3-yl}phenyl)-5-nitrobenzamide

SMILES

CC(N1c(cc2)ccc2NC(c(cc(cc2)[N+]([O-])=O)c2Cl)=O)=Nc(nccc2)c2C1=O

InChI

InChI=1S/C21H14ClN5O4/c1-12-24-19-16(3-2-10-23-19)21(29)26(12)14-6-4-13(5-7-14)25-20(28)17-11-15(27(30)31)8-9-18(17)22/h2-11H,1H3,(H,25,28)

InChI Key

AWXUOJRADHZDFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08537276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.83

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.084

Distribution Coefficient, logD

2.976

Water Solubility, LogSw

-3.76

Polar Surface Area

89.870

Acid Dissociation Constant (pKa)

8.89

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

F306-0059 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Structure:
  • Cyclic compounds
  • 3D
  • Fragments
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F306-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F306-0059?
Check Price and Availability of F306-0059, 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 F306-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F306-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F306-0059
  • 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 F306-0059 available by request