M867-1181 Screening compound: 2-{6-cyclopropyl-5,7-dioxo-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl}-N-(2,4-difluorophenyl)acetamide

M867-1181 Screening compound: 2-{6-cyclopropyl-5,7-dioxo-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl}-N-(2,4-difluorophenyl)acetamide
M867-1181 Screening compound: 2-{6-cyclopropyl-5,7-dioxo-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl}-N-(2,4-difluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M867-1181
2-{6-cyclopropyl-5,7-dioxo-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl}-N-(2,4-difluorophenyl)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

M867-1181

Molecular Formula

C16H12F2N4O3S (C16 H12 F2 N4 O3 S)

Compound Name

2-{6-cyclopropyl-5,7-dioxo-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl}-N-(2,4-difluorophenyl)acetamide

IUPAC name

2-{6-cyclopropyl-57-dioxo-4H5H6H7H-[12]thiazolo[43-d]pyrimidin-4-yl}-N-(24-difluorophenyl)acetamide

SMILES

O=C(CN(c1csnc1C(N1C2CC2)=O)C1=O)Nc(ccc(F)c1)c1F

InChI

InChI=1S/C16H12F2N4O3S/c17-8-1-4-11(10(18)5-8)19-13(23)6-21-12-7-26-20-14(12)15(24)22(16(21)25)9-2-3-9/h1,4-5,7,9H,2-3,6H2,(H,19,23)

InChI Key

AWDHDSCGRXOGSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27555849

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.090

Distribution Coefficient, logD

2.082

Water Solubility, LogSw

-2.95

Polar Surface Area

64.362

Acid Dissociation Constant (pKa)

9.11

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

M867-1181 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 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 M867-1181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M867-1181?
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What is the minimum amount of M867-1181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M867-1181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M867-1181
  • 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 M867-1181 available by request