2556-0063 Screening compound: ethyl (2E)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

2556-0063 Screening compound: ethyl (2E)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
2556-0063 Screening compound: ethyl (2E)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2556-0063
ethyl (2E)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-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

2556-0063

Molecular Formula

C28H28N2O6S (C28 H28 N2 O6 S)

Compound Name

ethyl (2E)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

ethyl (2E)-5-(34-dimethoxyphenyl)-7-methyl-3-oxo-2-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCOC(C(C(c(cc1)cc(OC)c1OC)N1C2=O)=C(C)N=C1S/C2=C/c(cc1)ccc1OCC=C)=O

InChI

InChI=1S/C28H28N2O6S/c1-6-14-36-20-11-8-18(9-12-20)15-23-26(31)30-25(19-10-13-21(33-4)22(16-19)34-5)24(27(32)35-7-2)17(3)29-28(30)37-23/h6,8-13,15-16,25H,1,7,14H2,2-5H3/t25-/m1/s1

InChI Key

WUFGWVLPAMHVAP-RUZDIDTESA-N

MDL Number (MFCD)

MFCD01163054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.678

Distribution Coefficient, logD

4.678

Water Solubility, LogSw

-4.55

Polar Surface Area

68.426

Acid Dissociation Constant (pKa)

27.35

Base Dissociation Constant (pKb)

2.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 2556-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2556-0063?
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What is the minimum amount of 2556-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2556-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2556-0063
  • 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 2556-0063 available by request