6187-0688 Screening compound: 2-methoxyethyl 5-(4-bromophenyl)-2-ethyl-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

6187-0688 Screening compound: 2-methoxyethyl 5-(4-bromophenyl)-2-ethyl-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
6187-0688 Screening compound: 2-methoxyethyl 5-(4-bromophenyl)-2-ethyl-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6187-0688
2-methoxyethyl 5-(4-bromophenyl)-2-ethyl-7-methyl-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

6187-0688

Molecular Formula

C19H21BrN2O4S (C19 H21 BrN2 O4 S)

Compound Name

2-methoxyethyl 5-(4-bromophenyl)-2-ethyl-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

2-methoxyethyl 5-(4-bromophenyl)-2-ethyl-7-methyl-3-oxo-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCC(C(N1C2c(cc3)ccc3Br)=O)SC1=NC(C)=C2C(OCCOC)=O

InChI

InChI=1S/C19H21BrN2O4S/c1-4-14-17(23)22-16(12-5-7-13(20)8-6-12)15(11(2)21-19(22)27-14)18(24)26-10-9-25-3/h5-8,14,16H,4,9-10H2,1-3H3

InChI Key

CYEZIYRAIFMZRL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04446228

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.263

Distribution Coefficient, logD

3.263

Water Solubility, LogSw

-3.21

Polar Surface Area

54.655

Acid Dissociation Constant (pKa)

19.86

Base Dissociation Constant (pKb)

3.36

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with 6187-0688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6187-0688?
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What is the minimum amount of 6187-0688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6187-0688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6187-0688
  • 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 6187-0688 available by request