1080-0307 Screening compound: 7-(diethylamino)-3-[(1E)-1-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]ethyl]-2H-chromen-2-one

1080-0307 Screening compound: 7-(diethylamino)-3-[(1E)-1-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]ethyl]-2H-chromen-2-one
1080-0307 Screening compound: 7-(diethylamino)-3-[(1E)-1-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]ethyl]-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1080-0307
7-(diethylamino)-3-[(1E)-1-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]ethyl]-2H-chromen-2-one

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

1080-0307

Molecular Formula

C21H21N5O6 (C21 H21 N5 O6)

Compound Name

7-(diethylamino)-3-[(1E)-1-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]ethyl]-2H-chromen-2-one

IUPAC name

7-(diethylamino)-3-[(1E)-1-[2-(24-dinitrophenyl)hydrazin-1-ylidene]ethyl]-2H-chromen-2-one

SMILES

CCN(CC)c(cc1)cc(O2)c1C=C(/C(/C)=N/Nc(ccc([N+]([O-])=O)c1)c1[N+]([O-])=O)C2=O

InChI

InChI=1S/C21H21N5O6/c1-4-24(5-2)15-7-6-14-10-17(21(27)32-20(14)12-15)13(3)22-23-18-9-8-16(25(28)29)11-19(18)26(30)31/h6-12,23H,4-5H2,1-3H3

InChI Key

GYDFUKDFUQANOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00713411

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.43

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.059

Distribution Coefficient, logD

4.993

Water Solubility, LogSw

-4.84

Polar Surface Area

110.085

Acid Dissociation Constant (pKa)

8.19

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

1080-0307 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 1080-0307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1080-0307?
Check Price and Availability of 1080-0307, 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 1080-0307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1080-0307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1080-0307
  • 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 1080-0307 available by request