F084-0319 Screening compound: 1-{3-[4-(2-furylcarbonyl)piperazino]-3-oxopropyl}-4-isobutylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

F084-0319 Screening compound: 1-{3-[4-(2-furylcarbonyl)piperazino]-3-oxopropyl}-4-isobutylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
F084-0319 Screening compound: 1-{3-[4-(2-furylcarbonyl)piperazino]-3-oxopropyl}-4-isobutylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F084-0319
1-{3-[4-(2-furylcarbonyl)piperazino]-3-oxopropyl}-4-isobutylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

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

F084-0319

Molecular Formula

C23H26N6O4S (C23 H26 N6 O4 S)

Compound Name

1-{3-[4-(2-furylcarbonyl)piperazino]-3-oxopropyl}-4-isobutylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

IUPAC name

12-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-8-(2-methylpropyl)-5-thia-181011-tetraazatricyclo[7.3.0.0^{26}]dodeca-2(6)3911-tetraen-7-one

SMILES

CC(C)CN(c1nnc(CCC(N(CC2)CCN2C(c2ccco2)=O)=O)n1-c1c2scc1)C2=O

InChI

InChI=1S/C23H26N6O4S/c1-15(2)14-28-22(32)20-16(7-13-34-20)29-18(24-25-23(28)29)5-6-19(30)26-8-10-27(11-9-26)21(31)17-4-3-12-33-17/h3-4,7,12-13,15H,5-6,8-11,14H2,1-2H3

InChI Key

WJUTZFZUEFVPNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14940224

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.552

Distribution Coefficient, logD

1.552

Water Solubility, LogSw

-1.99

Polar Surface Area

82.423

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

-2.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with F084-0319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F084-0319?
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What is the minimum amount of F084-0319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F084-0319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F084-0319
  • 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 F084-0319 available by request