0657-0068 Screening compound: N'-[7-(diethylamino)-2-oxo-2H-chromene-3-carboximidoyl]benzohydrazide

0657-0068 Screening compound: N'-[7-(diethylamino)-2-oxo-2H-chromene-3-carboximidoyl]benzohydrazide
0657-0068 Screening compound: N'-[7-(diethylamino)-2-oxo-2H-chromene-3-carboximidoyl]benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0657-0068
N'-[7-(diethylamino)-2-oxo-2H-chromene-3-carboximidoyl]benzohydrazide

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

0657-0068

Molecular Formula

C21H22N4O3 (C21 H22 N4 O3)

Compound Name

N'-[7-(diethylamino)-2-oxo-2H-chromene-3-carboximidoyl]benzohydrazide

IUPAC name

N'-[7-(diethylamino)-2-oxo-2H-chromene-3-carboximidoyl]benzohydrazide

SMILES

CCN(CC)c(cc1)cc(O2)c1C=C(C(NNC(c1ccccc1)=O)=N)C2=O

InChI

InChI=1S/C21H22N4O3/c1-3-25(4-2)16-11-10-15-12-17(21(27)28-18(15)13-16)19(22)23-24-20(26)14-8-6-5-7-9-14/h5-13H,3-4H2,1-2H3,(H2,22,23)(H,24,26)

InChI Key

ITOXBCRUOYYGLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00990381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.723

Distribution Coefficient, logD

2.706

Water Solubility, LogSw

-3.34

Polar Surface Area

79.204

Acid Dissociation Constant (pKa)

8.79

Base Dissociation Constant (pKb)

7.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

0657-0068 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 0657-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0657-0068?
Check Price and Availability of 0657-0068, 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 0657-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0657-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0657-0068
  • 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 0657-0068 available by request