D715-1052 Screening compound: 2-(4-bromophenyl)-5,9,10-trimethyl-2H,3H,4H,8H-pyrano[2,3-f]chromene-4,8-dione

D715-1052 Screening compound: 2-(4-bromophenyl)-5,9,10-trimethyl-2H,3H,4H,8H-pyrano[2,3-f]chromene-4,8-dione
D715-1052 Screening compound: 2-(4-bromophenyl)-5,9,10-trimethyl-2H,3H,4H,8H-pyrano[2,3-f]chromene-4,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D715-1052
2-(4-bromophenyl)-5,9,10-trimethyl-2H,3H,4H,8H-pyrano[2,3-f]chromene-4,8-dione

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

D715-1052

Molecular Formula

C21H17BrO4 (C21 H17 BrO4)

Compound Name

2-(4-bromophenyl)-5,9,10-trimethyl-2H,3H,4H,8H-pyrano[2,3-f]chromene-4,8-dione

IUPAC name

2-(4-bromophenyl)-5910-trimethyl-2H3H4H8H-pyrano[23-f]chromene-48-dione

SMILES

Cc1c(C(CC(c(cc2)ccc2Br)O2)=O)c2c(C(C)=C(C)C(O2)=O)c2c1

InChI

InChI=1S/C21H17BrO4/c1-10-8-17-19(11(2)12(3)21(24)26-17)20-18(10)15(23)9-16(25-20)13-4-6-14(22)7-5-13/h4-8,16H,9H2,1-3H3/t16-/m0/s1

InChI Key

VPIMUBYWAXPFRG-INIZCTEOSA-N

MDL Number (MFCD)

MFCD09851037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.222

Distribution Coefficient, logD

5.222

Water Solubility, LogSw

-5.34

Polar Surface Area

40.808

Acid Dissociation Constant (pKa)

20.06

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

D715-1052 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D715-1052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D715-1052?
Check Price and Availability of D715-1052, 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 D715-1052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D715-1052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D715-1052
  • 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 D715-1052 available by request