6187-0794 Screening compound: prop-2-en-1-yl 2,7-dimethyl-5-(4-methylphenyl)-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

6187-0794 Screening compound: prop-2-en-1-yl 2,7-dimethyl-5-(4-methylphenyl)-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
6187-0794 Screening compound: prop-2-en-1-yl 2,7-dimethyl-5-(4-methylphenyl)-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6187-0794
prop-2-en-1-yl 2,7-dimethyl-5-(4-methylphenyl)-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

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

6187-0794

Molecular Formula

C19H20N2O3S (C19 H20 N2 O3 S)

Compound Name

prop-2-en-1-yl 2,7-dimethyl-5-(4-methylphenyl)-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

prop-2-en-1-yl 27-dimethyl-5-(4-methylphenyl)-3-oxo-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(C(N1C2c3ccc(C)cc3)=O)SC1=NC(C)=C2C(OCC=C)=O

InChI

InChI=1S/C19H20N2O3S/c1-5-10-24-18(23)15-12(3)20-19-21(17(22)13(4)25-19)16(15)14-8-6-11(2)7-9-14/h5-9,13,16H,1,10H2,2-4H3

InChI Key

UGGHADDEDAMHSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04446191

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.264

Distribution Coefficient, logD

3.264

Water Solubility, LogSw

-3.27

Polar Surface Area

46.313

Acid Dissociation Constant (pKa)

19.50

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with 6187-0794 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6187-0794?
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What is the minimum amount of 6187-0794 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6187-0794
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6187-0794
  • 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 6187-0794 available by request