F718-0477 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-(2-pyridylmethyl)acetamide

F718-0477 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-(2-pyridylmethyl)acetamide
F718-0477 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-(2-pyridylmethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F718-0477
2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-(2-pyridylmethyl)acetamide

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

F718-0477

Molecular Formula

C18H13FN4OS2 (C18 H13 FN4 OS2)

Compound Name

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

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-[(pyridin-2-yl)methyl]acetamide

SMILES

O=C(CSc(ncnc12)c1sc1c2c(F)ccc1)NCc1ncccc1

InChI

InChI=1S/C18H13FN4OS2/c19-12-5-3-6-13-15(12)16-17(26-13)18(23-10-22-16)25-9-14(24)21-8-11-4-1-2-7-20-11/h1-7,10H,8-9H2,(H,21,24)

InChI Key

RTKSJFWNPWIWPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27187400

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.379

Distribution Coefficient, logD

3.379

Water Solubility, LogSw

-3.83

Polar Surface Area

55.155

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

F718-0477 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Targeted Diversity Library (40567 compounds)

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F718-0477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F718-0477?
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What is the minimum amount of F718-0477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F718-0477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F718-0477
  • 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 F718-0477 available by request