E765-0009 Screening compound: (9-hydroxy-1,7,7-trimethyl-8,9-dihydro-7H-furo[3,2-f]chromen-2-yl)(4-phenylpiperazino)methanone

E765-0009 Screening compound: (9-hydroxy-1,7,7-trimethyl-8,9-dihydro-7H-furo[3,2-f]chromen-2-yl)(4-phenylpiperazino)methanone
E765-0009 Screening compound: (9-hydroxy-1,7,7-trimethyl-8,9-dihydro-7H-furo[3,2-f]chromen-2-yl)(4-phenylpiperazino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound E765-0009
(9-hydroxy-1,7,7-trimethyl-8,9-dihydro-7H-furo[3,2-f]chromen-2-yl)(4-phenylpiperazino)methanone

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

E765-0009

Molecular Formula

C25H28N2O4 (C25 H28 N2 O4)

Compound Name

(9-hydroxy-1,7,7-trimethyl-8,9-dihydro-7H-furo[3,2-f]chromen-2-yl)(4-phenylpiperazino)methanone

IUPAC name

31111-trimethyl-4-(4-phenylpiperazine-1-carbonyl)-510-dioxatricyclo[7.4.0.0^{26}]trideca-1368-tetraen-13-ol

SMILES

CC(C)(CC1O)Oc(cc2)c1c1c2oc(C(N(CC2)CCN2c2ccccc2)=O)c1C

InChI

InChI=1S/C25H28N2O4/c1-16-21-19(9-10-20-22(21)18(28)15-25(2,3)31-20)30-23(16)24(29)27-13-11-26(12-14-27)17-7-5-4-6-8-17/h4-10,18,28H,11-15H2,1-3H3/t18-/m0/s1

InChI Key

GFCPICUYOOZJNK-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14917247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.027

Distribution Coefficient, logD

4.027

Water Solubility, LogSw

-4.29

Polar Surface Area

50.622

Acid Dissociation Constant (pKa)

14.66

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

E765-0009 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

GPCR Targeted Library (31838 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E765-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E765-0009?
Check Price and Availability of E765-0009, 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 E765-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E765-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E765-0009
  • 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 E765-0009 available by request