F718-0537 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-propylacetamide

F718-0537 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-propylacetamide
F718-0537 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F718-0537
2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-propylacetamide

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

F718-0537

Molecular Formula

C15H14FN3OS2 (C15 H14 FN3 OS2)

Compound Name

2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-propylacetamide

IUPAC name

2-({13-fluoro-8-thia-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-yl}sulfanyl)-N-propylacetamide

SMILES

CCCNC(CSc(ncnc12)c1sc1c2c(F)ccc1)=O

InChI

InChI=1S/C15H14FN3OS2/c1-2-6-17-11(20)7-21-15-14-13(18-8-19-15)12-9(16)4-3-5-10(12)22-14/h3-5,8H,2,6-7H2,1H3,(H,17,20)

InChI Key

QJCGVGVJFSLVJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14964454

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.356

Distribution Coefficient, logD

3.356

Water Solubility, LogSw

-3.73

Polar Surface Area

45.725

Acid Dissociation Constant (pKa)

15.74

Base Dissociation Constant (pKb)

3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

F718-0537 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F718-0537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F718-0537?
Check Price and Availability of F718-0537, 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 F718-0537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F718-0537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F718-0537
  • 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 F718-0537 available by request