M867-0400 Screening compound: 2-[6-(2-methylpropyl)-5,7-dioxo-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide

M867-0400 Screening compound: 2-[6-(2-methylpropyl)-5,7-dioxo-4H,5H,6H,7H-[1,2]thiazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
M867-0400 Screening compound: 2-[6-(2-methylpropyl)-5,7-dioxo-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 M867-0400
2-[6-(2-methylpropyl)-5,7-dioxo-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

M867-0400

Molecular Formula

C18H17F3N4O3S (C18 H17 F3 N4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C18H17F3N4O3S/c1-10(2)7-25-16(27)15-13(9-29-23-15)24(17(25)28)8-14(26)22-12-6-4-3-5-11(12)18(19,20)21/h3-6,9-10H,7-8H2,1-2H3,(H,22,26)

InChI Key

XLCSVPITMDDHIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27555647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.545

Distribution Coefficient, logD

3.545

Water Solubility, LogSw

-3.86

Polar Surface Area

65.081

Acid Dissociation Constant (pKa)

12.55

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with M867-0400 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M867-0400?
Check Price and Availability of M867-0400, 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 M867-0400 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M867-0400
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M867-0400
  • 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 M867-0400 available by request