M142-0280 Screening compound: N~1~-(3,5-difluorobenzyl)-2-{[8-(dimethylamino)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide

M142-0280 Screening compound: N~1~-(3,5-difluorobenzyl)-2-{[8-(dimethylamino)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
M142-0280 Screening compound: N~1~-(3,5-difluorobenzyl)-2-{[8-(dimethylamino)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M142-0280
N~1~-(3,5-difluorobenzyl)-2-{[8-(dimethylamino)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-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

M142-0280

Molecular Formula

C17H15F2N7OS2 (C17 H15 F2 N7 OS2)

Compound Name

N~1~-(3,5-difluorobenzyl)-2-{[8-(dimethylamino)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide

IUPAC name

N-[(35-difluorophenyl)methyl]-2-{[11-(dimethylamino)-12-thia-346810-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(9)24710-pentaen-5-yl]sulfanyl}acetamide

SMILES

CN(C)c1nc(ncn2c(SCC(NCc3cc(F)cc(F)c3)=O)nnc22)c2s1

InChI

InChI=1S/C17H15F2N7OS2/c1-25(2)16-22-14-13(29-16)15-23-24-17(26(15)8-21-14)28-7-12(27)20-6-9-3-10(18)5-11(19)4-9/h3-5,8H,6-7H2,1-2H3,(H,20,27)

InChI Key

KRZRXMOYPYEFRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27532281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.587

Distribution Coefficient, logD

2.587

Water Solubility, LogSw

-2.68

Polar Surface Area

69.202

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

M142-0280 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M142-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M142-0280?
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What is the minimum amount of M142-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M142-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M142-0280
  • 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 M142-0280 available by request