G966-0060 Screening compound: ethyl 4-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)oxy]benzoate

G966-0060 Screening compound: ethyl 4-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)oxy]benzoate
G966-0060 Screening compound: ethyl 4-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)oxy]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G966-0060
ethyl 4-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)oxy]benzoate

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

G966-0060

Molecular Formula

C20H16N2O4 (C20 H16 N2 O4)

Compound Name

ethyl 4-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)oxy]benzoate

IUPAC name

ethyl 4-({4-methyl-8-oxa-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-yl}oxy)benzoate

SMILES

CCOC(c(cc1)ccc1Oc1nc(C)nc2c1oc1c2cccc1)=O

InChI

InChI=1S/C20H16N2O4/c1-3-24-20(23)13-8-10-14(11-9-13)25-19-18-17(21-12(2)22-19)15-6-4-5-7-16(15)26-18/h4-11H,3H2,1-2H3

InChI Key

UDZKIKJDSBBEHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15077417

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.008

Distribution Coefficient, logD

5.008

Water Solubility, LogSw

-4.84

Polar Surface Area

55.586

Acid Dissociation Constant (pKa)

30.16

Base Dissociation Constant (pKb)

2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

G966-0060 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G966-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G966-0060?
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What is the minimum amount of G966-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G966-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G966-0060
  • 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 G966-0060 available by request