F027-0058 Screening compound: 6-methyl-2-[(2-phenylethyl)amino]-3-(3,4,5-trimethoxyphenyl)-4H-furo[3,2-c]pyran-4-one

F027-0058 Screening compound: 6-methyl-2-[(2-phenylethyl)amino]-3-(3,4,5-trimethoxyphenyl)-4H-furo[3,2-c]pyran-4-one
F027-0058 Screening compound: 6-methyl-2-[(2-phenylethyl)amino]-3-(3,4,5-trimethoxyphenyl)-4H-furo[3,2-c]pyran-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F027-0058
6-methyl-2-[(2-phenylethyl)amino]-3-(3,4,5-trimethoxyphenyl)-4H-furo[3,2-c]pyran-4-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

F027-0058

Molecular Formula

C25H25NO6 (C25 H25 NO6)

Compound Name

6-methyl-2-[(2-phenylethyl)amino]-3-(3,4,5-trimethoxyphenyl)-4H-furo[3,2-c]pyran-4-one

IUPAC name

6-methyl-2-[(2-phenylethyl)amino]-3-(345-trimethoxyphenyl)-4H-furo[32-c]pyran-4-one

SMILES

CC(O1)=Cc(oc(NCCc2ccccc2)c2-c(cc3OC)cc(OC)c3OC)c2C1=O

InChI

InChI=1S/C25H25NO6/c1-15-12-18-22(25(27)31-15)21(17-13-19(28-2)23(30-4)20(14-17)29-3)24(32-18)26-11-10-16-8-6-5-7-9-16/h5-9,12-14,26H,10-11H2,1-4H3

InChI Key

JPTVOJQUSAPEPQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10045269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.603

Distribution Coefficient, logD

3.603

Water Solubility, LogSw

-4.02

Polar Surface Area

64.330

Acid Dissociation Constant (pKa)

18.79

Base Dissociation Constant (pKb)

-6.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F027-0058 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F027-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F027-0058?
Check Price and Availability of F027-0058, 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 F027-0058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F027-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F027-0058
  • 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 F027-0058 available by request