1682-7785 Screening compound: 6-oxo-6H-benzo[c]chromen-3-yl 3,5-dinitrobenzoate

1682-7785 Screening compound: 6-oxo-6H-benzo[c]chromen-3-yl 3,5-dinitrobenzoate
1682-7785 Screening compound: 6-oxo-6H-benzo[c]chromen-3-yl 3,5-dinitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-7785
6-oxo-6H-benzo[c]chromen-3-yl 3,5-dinitrobenzoate

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

1682-7785

Molecular Formula

C20H10N2O8 (C20 H10 N2 O8)

Compound Name

6-oxo-6H-benzo[c]chromen-3-yl 3,5-dinitrobenzoate

IUPAC name

6-oxo-6H-benzo[c]chromen-3-yl 35-dinitrobenzoate

SMILES

[O-][N+](c1cc(C(Oc(cc2)cc(O3)c2-c(cccc2)c2C3=O)=O)cc([N+]([O-])=O)c1)=O

InChI

InChI=1S/C20H10N2O8/c23-19(11-7-12(21(25)26)9-13(8-11)22(27)28)29-14-5-6-16-15-3-1-2-4-17(15)20(24)30-18(16)10-14/h1-10H

InChI Key

LQUFZSDMIZVXCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00709756

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.31

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.288

Distribution Coefficient, logD

3.288

Water Solubility, LogSw

-4.38

Polar Surface Area

108.029

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 1682-7785 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-7785?
Check Price and Availability of 1682-7785, 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 1682-7785 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-7785
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-7785
  • 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 1682-7785 available by request