F464-0107 Screening compound: N~1~-(2,4-dimethylphenyl)-2-[9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide

F464-0107 Screening compound: N~1~-(2,4-dimethylphenyl)-2-[9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
F464-0107 Screening compound: N~1~-(2,4-dimethylphenyl)-2-[9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F464-0107
N~1~-(2,4-dimethylphenyl)-2-[9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]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

F464-0107

Molecular Formula

C20H16FN3O2S (C20 H16 FN3 O2 S)

Compound Name

N~1~-(2,4-dimethylphenyl)-2-[9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide

IUPAC name

N-(24-dimethylphenyl)-2-{13-fluoro-6-oxo-8-thia-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-5-yl}acetamide

SMILES

Cc(cc1)cc(C)c1NC(CN(C=Nc1c2sc3c1c(F)ccc3)C2=O)=O

InChI

InChI=1S/C20H16FN3O2S/c1-11-6-7-14(12(2)8-11)23-16(25)9-24-10-22-18-17-13(21)4-3-5-15(17)27-19(18)20(24)26/h3-8,10H,9H2,1-2H3,(H,23,25)

InChI Key

KFFDXLZNOYJRPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11994830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.765

Distribution Coefficient, logD

3.765

Water Solubility, LogSw

-4.05

Polar Surface Area

47.285

Acid Dissociation Constant (pKa)

12.55

Base Dissociation Constant (pKb)

-0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with F464-0107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F464-0107?
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What is the minimum amount of F464-0107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F464-0107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F464-0107
  • 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 F464-0107 available by request