3971-1907 Screening compound: ethyl (2E)-5-(4-chlorophenyl)-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-7-phenyl-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

3971-1907 Screening compound: ethyl (2E)-5-(4-chlorophenyl)-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-7-phenyl-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
3971-1907 Screening compound: ethyl (2E)-5-(4-chlorophenyl)-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-7-phenyl-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3971-1907
ethyl (2E)-5-(4-chlorophenyl)-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-7-phenyl-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

3971-1907

Molecular Formula

C30H26ClN3O5S (C30 H26 ClN3 O5 S)

Compound Name

ethyl (2E)-5-(4-chlorophenyl)-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-7-phenyl-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

ethyl (2E)-5-(4-chlorophenyl)-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-7-phenyl-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCOC(C(C(c(cc1)ccc1Cl)N1C2=O)=C(c3ccccc3)N=C1S/C2=C/c1ccc(N2CCOCC2)o1)=O

InChI

InChI=1S/C30H26ClN3O5S/c1-2-38-29(36)25-26(19-6-4-3-5-7-19)32-30-34(27(25)20-8-10-21(31)11-9-20)28(35)23(40-30)18-22-12-13-24(39-22)33-14-16-37-17-15-33/h3-13,18,27H,2,14-17H2,1H3/t27-/m0/s1

InChI Key

HJVWBCRSHQJCSK-MHZLTWQESA-N

MDL Number (MFCD)

MFCD02374439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

576.07

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.027

Distribution Coefficient, logD

6.027

Water Solubility, LogSw

-6.27

Polar Surface Area

65.787

Acid Dissociation Constant (pKa)

26.13

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with 3971-1907 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3971-1907?
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What is the minimum amount of 3971-1907 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3971-1907
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3971-1907
  • 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 3971-1907 available by request