G966-0233 Screening compound: 1,3-benzodioxol-5-ylmethyl (2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl) ether

G966-0233 Screening compound: 1,3-benzodioxol-5-ylmethyl (2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl) ether
G966-0233 Screening compound: 1,3-benzodioxol-5-ylmethyl (2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl) ether alternative view

Chemical Structure Depiction of ChemDiv screening compound G966-0233
1,3-benzodioxol-5-ylmethyl (2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl) ether

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

G966-0233

Molecular Formula

C24H16N2O4 (C24 H16 N2 O4)

Compound Name

1,3-benzodioxol-5-ylmethyl (2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl) ether

IUPAC name

6-[(2H-13-benzodioxol-5-yl)methoxy]-4-phenyl-8-oxa-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaene

SMILES

C(c(cc1)cc2c1OCO2)Oc1c2oc(cccc3)c3c2nc(-c2ccccc2)n1

InChI

InChI=1S/C24H16N2O4/c1-2-6-16(7-3-1)23-25-21-17-8-4-5-9-18(17)30-22(21)24(26-23)27-13-15-10-11-19-20(12-15)29-14-28-19/h1-12H,13-14H2

InChI Key

NVOHUEBNTIRGEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15077466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.373

Distribution Coefficient, logD

6.373

Water Solubility, LogSw

-6.52

Polar Surface Area

52.543

Acid Dissociation Constant (pKa)

24.37

Base Dissociation Constant (pKb)

3.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

G966-0233 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anti-Inflammatory Library (24602 compounds)

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G966-0233 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G966-0233?
Check Price and Availability of G966-0233, 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 G966-0233 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G966-0233
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G966-0233
  • 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 G966-0233 available by request