7287-0946 Screening compound: N-[1]benzofuro[3,2-d]pyrimidin-4-yl-N-(2-fluorophenyl)amine

7287-0946 Screening compound: N-[1]benzofuro[3,2-d]pyrimidin-4-yl-N-(2-fluorophenyl)amine
7287-0946 Screening compound: N-[1]benzofuro[3,2-d]pyrimidin-4-yl-N-(2-fluorophenyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7287-0946
N-[1]benzofuro[3,2-d]pyrimidin-4-yl-N-(2-fluorophenyl)amine

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

7287-0946

Molecular Formula

C16H10FN3O (C16 H10 FN3 O)

Compound Name

N-[1]benzofuro[3,2-d]pyrimidin-4-yl-N-(2-fluorophenyl)amine

IUPAC name

N-(2-fluorophenyl)-8-oxa-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-amine

SMILES

Fc(cccc1)c1Nc1ncnc2c1oc1c2cccc1

InChI

InChI=1S/C16H10FN3O/c17-11-6-2-3-7-12(11)20-16-15-14(18-9-19-16)10-5-1-4-8-13(10)21-15/h1-9H,(H,18,19,20)

InChI Key

YCGMPXXRGKHCQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04157705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.229

Distribution Coefficient, logD

4.228

Water Solubility, LogSw

-4.50

Polar Surface Area

37.807

Acid Dissociation Constant (pKa)

16.35

Base Dissociation Constant (pKb)

4.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

7287-0946 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7287-0946 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7287-0946?
Check Price and Availability of 7287-0946, 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 7287-0946 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7287-0946
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7287-0946
  • 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 7287-0946 available by request