F718-0484 Screening compound: N~1~-(sec-butyl)-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide

F718-0484 Screening compound: N~1~-(sec-butyl)-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
F718-0484 Screening compound: N~1~-(sec-butyl)-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F718-0484
N~1~-(sec-butyl)-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]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

F718-0484

Molecular Formula

C16H16FN3OS2 (C16 H16 FN3 OS2)

Compound Name

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

IUPAC name

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

SMILES

CCC(C)NC(CSc(ncnc12)c1sc1c2c(F)ccc1)=O

InChI

InChI=1S/C16H16FN3OS2/c1-3-9(2)20-12(21)7-22-16-15-14(18-8-19-16)13-10(17)5-4-6-11(13)23-15/h4-6,8-9H,3,7H2,1-2H3,(H,20,21)/t9-/m0/s1

InChI Key

WXJAKCYMKUHPOV-VIFPVBQESA-N

MDL Number (MFCD)

MFCD14964431

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.45

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

3.755

Distribution Coefficient, logD

3.755

Water Solubility, LogSw

-4.14

Polar Surface Area

45.325

Acid Dissociation Constant (pKa)

15.97

Base Dissociation Constant (pKb)

3.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.30

F718-0484 in Drug Discovery

Included in Screening Libraries

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F718-0484 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F718-0484?
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What is the minimum amount of F718-0484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F718-0484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F718-0484
  • 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 F718-0484 available by request