M867-0989 Screening compound: 2-[5,7-dioxo-6-(propan-2-yl)-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide

M867-0989 Screening compound: 2-[5,7-dioxo-6-(propan-2-yl)-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
M867-0989 Screening compound: 2-[5,7-dioxo-6-(propan-2-yl)-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M867-0989
2-[5,7-dioxo-6-(propan-2-yl)-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]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

M867-0989

Molecular Formula

C17H15F3N4O3S (C17 H15 F3 N4 O3 S)

Compound Name

2-[5,7-dioxo-6-(propan-2-yl)-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide

IUPAC name

2-[57-dioxo-6-(propan-2-yl)-4H5H6H7H-[12]thiazolo[43-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide

SMILES

CC(C)N(C(c1nscc1N1CC(Nc2c(C(F)(F)F)cccc2)=O)=O)C1=O

InChI

InChI=1S/C17H15F3N4O3S/c1-9(2)24-15(26)14-12(8-28-22-14)23(16(24)27)7-13(25)21-11-6-4-3-5-10(11)17(18,19)20/h3-6,8-9H,7H2,1-2H3,(H,21,25)

InChI Key

JSHRVPUKVGWQPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27555771

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.911

Distribution Coefficient, logD

2.911

Water Solubility, LogSw

-3.60

Polar Surface Area

64.802

Acid Dissociation Constant (pKa)

12.55

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with M867-0989 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M867-0989?
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What is the minimum amount of M867-0989 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M867-0989
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M867-0989
  • 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 M867-0989 available by request