8017-8710 Screening compound: 4-(3,4,5-trimethoxyphenyl)-2H,3H,4H,5H,10H-naphtho[2,3-b]pyran-2,5,10-trione

8017-8710 Screening compound: 4-(3,4,5-trimethoxyphenyl)-2H,3H,4H,5H,10H-naphtho[2,3-b]pyran-2,5,10-trione
8017-8710 Screening compound: 4-(3,4,5-trimethoxyphenyl)-2H,3H,4H,5H,10H-naphtho[2,3-b]pyran-2,5,10-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-8710
4-(3,4,5-trimethoxyphenyl)-2H,3H,4H,5H,10H-naphtho[2,3-b]pyran-2,5,10-trione

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

8017-8710

Molecular Formula

C22H18O7 (C22 H18 O7)

Compound Name

4-(3,4,5-trimethoxyphenyl)-2H,3H,4H,5H,10H-naphtho[2,3-b]pyran-2,5,10-trione

IUPAC name

4-(345-trimethoxyphenyl)-2H3H4H5H10H-naphtho[23-b]pyran-2510-trione

SMILES

COc1cc(C(C2)C(C(c(cccc3)c3C3=O)=O)=C3OC2=O)cc(OC)c1OC

InChI

InChI=1S/C22H18O7/c1-26-15-8-11(9-16(27-2)21(15)28-3)14-10-17(23)29-22-18(14)19(24)12-6-4-5-7-13(12)20(22)25/h4-9,14H,10H2,1-3H3/t14-/m1/s1

InChI Key

CVELJSGQGXEWKY-CQSZACIVSA-N

MDL Number (MFCD)

MFCD06618888

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.647

Distribution Coefficient, logD

2.647

Water Solubility, LogSw

-3.42

Polar Surface Area

70.050

Acid Dissociation Constant (pKa)

18.90

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

8017-8710 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8017-8710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-8710?
Check Price and Availability of 8017-8710, 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 8017-8710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-8710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-8710
  • 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 8017-8710 available by request