2081-0526 Screening compound: 4-METHOXY-N1-[3-METHYL-4-(2-OXO-2H-CHROMEN-3-YL)PHENYL]-3-NITROBENZAMIDE

2081-0526 Screening compound: 4-METHOXY-N1-[3-METHYL-4-(2-OXO-2H-CHROMEN-3-YL)PHENYL]-3-NITROBENZAMIDE
2081-0526 Screening compound: 4-METHOXY-N1-[3-METHYL-4-(2-OXO-2H-CHROMEN-3-YL)PHENYL]-3-NITROBENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 2081-0526
4-METHOXY-N1-[3-METHYL-4-(2-OXO-2H-CHROMEN-3-YL)PHENYL]-3-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

2081-0526

Molecular Formula

C24H18N2O6 (C24 H18 N2 O6)

Compound Name

4-METHOXY-N1-[3-METHYL-4-(2-OXO-2H-CHROMEN-3-YL)PHENYL]-3-NITROBENZAMIDE

IUPAC name

n/a

SMILES

Cc(cc(cc1)NC(c(cc2)cc([N+]([O-])=O)c2OC)=O)c1C1=Cc(cccc2)c2OC1=O

InChI

InChI=1S/C24H18N2O6/c1-14-11-17(25-23(27)16-7-10-22(31-2)20(13-16)26(29)30)8-9-18(14)19-12-15-5-3-4-6-21(15)32-24(19)28/h3-13H,1-2H3,(H,25,27)

InChI Key

IHYNNYAHKUGVJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01145221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.114

Distribution Coefficient, logD

4.111

Water Solubility, LogSw

-4.40

Polar Surface Area

84.691

Acid Dissociation Constant (pKa)

9.59

Base Dissociation Constant (pKb)

-5.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

2081-0526 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 2081-0526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2081-0526?
Check Price and Availability of 2081-0526, 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 2081-0526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2081-0526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2081-0526
  • 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 2081-0526 available by request