F151-0405 Screening compound: N-(2-chlorophenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}propanamide

F151-0405 Screening compound: N-(2-chlorophenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}propanamide
F151-0405 Screening compound: N-(2-chlorophenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F151-0405
N-(2-chlorophenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}propanamide

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

F151-0405

Molecular Formula

C21H20ClN5O3S (C21 H20 ClN5 O3 S)

Compound Name

N-(2-chlorophenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}propanamide

IUPAC name

N-(2-chlorophenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-45-dihydro-124-triazin-3-yl]sulfanyl}propanamide

SMILES

CCC(Nc(cccc1)c1C(C(N1)=O)=NN=C1SC(C)C(Nc(cccc1)c1Cl)=O)=O

InChI

InChI=1S/C21H20ClN5O3S/c1-3-17(28)23-15-10-6-4-8-13(15)18-20(30)25-21(27-26-18)31-12(2)19(29)24-16-11-7-5-9-14(16)22/h4-12H,3H2,1-2H3,(H,23,28)(H,24,29)(H,25,27,30)/t12-/m0/s1

InChI Key

HIMMXHBZMIYKHY-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD27105480

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.94

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.364

Distribution Coefficient, logD

3.302

Water Solubility, LogSw

-3.57

Polar Surface Area

89.912

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

1.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

F151-0405 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with F151-0405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F151-0405?
Check Price and Availability of F151-0405, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F151-0405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F151-0405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F151-0405
  • 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 F151-0405 available by request