F151-0521 Screening compound: N-{2-[3-({[(4-chlorophenyl)carbamoyl]methyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}benzamide

F151-0521 Screening compound: N-{2-[3-({[(4-chlorophenyl)carbamoyl]methyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}benzamide
F151-0521 Screening compound: N-{2-[3-({[(4-chlorophenyl)carbamoyl]methyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F151-0521
N-{2-[3-({[(4-chlorophenyl)carbamoyl]methyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}benzamide

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

F151-0521

Molecular Formula

C24H18ClN5O3S (C24 H18 ClN5 O3 S)

Compound Name

N-{2-[3-({[(4-chlorophenyl)carbamoyl]methyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}benzamide

IUPAC name

N-{2-[3-({[(4-chlorophenyl)carbamoyl]methyl}sulfanyl)-5-oxo-45-dihydro-124-triazin-6-yl]phenyl}benzamide

SMILES

O=C(CSC(N1)=NN=C(c(cccc2)c2NC(c2ccccc2)=O)C1=O)Nc(cc1)ccc1Cl

InChI

InChI=1S/C24H18ClN5O3S/c25-16-10-12-17(13-11-16)26-20(31)14-34-24-28-23(33)21(29-30-24)18-8-4-5-9-19(18)27-22(32)15-6-2-1-3-7-15/h1-13H,14H2,(H,26,31)(H,27,32)(H,28,30,33)

InChI Key

GTKVTONHDPLAJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27105544

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.96

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

4.272

Distribution Coefficient, logD

4.117

Water Solubility, LogSw

-4.77

Polar Surface Area

90.338

Acid Dissociation Constant (pKa)

7.77

Base Dissociation Constant (pKb)

1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

F151-0521 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F151-0521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F151-0521?
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What is the minimum amount of F151-0521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F151-0521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F151-0521
  • 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 F151-0521 available by request