F718-0653 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-[2-(4-methylpiperazino)ethyl]acetamide

F718-0653 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-[2-(4-methylpiperazino)ethyl]acetamide
F718-0653 Screening compound: 2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-[2-(4-methylpiperazino)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F718-0653
2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N~1~-[2-(4-methylpiperazino)ethyl]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

F718-0653

Molecular Formula

C19H22FN5OS2 (C19 H22 FN5 OS2)

Compound Name

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

SMILES

CN1CCN(CCNC(CSc(ncnc23)c2sc2c3c(F)ccc2)=O)CC1

InChI

InChI=1S/C19H22FN5OS2/c1-24-7-9-25(10-8-24)6-5-21-15(26)11-27-19-18-17(22-12-23-19)16-13(20)3-2-4-14(16)28-18/h2-4,12H,5-11H2,1H3,(H,21,26)

InChI Key

HCKDMLVLVDBYOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14964504

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.116

Distribution Coefficient, logD

1.448

Water Solubility, LogSw

-2.73

Polar Surface Area

52.913

Acid Dissociation Constant (pKa)

14.02

Base Dissociation Constant (pKb)

7.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with F718-0653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F718-0653?
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What is the minimum amount of F718-0653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F718-0653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F718-0653
  • 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 F718-0653 available by request