(E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile
TL;DR: (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile (CAS 845903-72-2) is a chemical compound with molecular formula C23H19N3O3S and molecular weight 417.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(5E)-5-benzylidene-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-3-morpholin-4-yl-3-oxopropanenitrile
Also Known As: (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile, (2E)-2-[(5E)-5-benzylidene-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-3-(morpholin-4-yl)-3-oxopropanenitrile, (2E)-2-[(5E)-5-benzylidene-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-3-morpholin-4-yl-3-oxopropanenitrile
| Molecular Formula | C23H19N3O3S |
|---|---|
| Molecular Weight | 417.11 g/mol |
| LogP | 1.26088 |
| Topological Polar Surface Area | 75.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.11472 |
| Heavy Atoms | 30 |
| Complexity | 1265.2129 |
Chemical Identifiers
| CAS Number | 845903-72-2 |
|---|---|
| SMILES | C1COCCN1C(=O)/C(=C/2\N(C(=O)/C(=C\C3=CC=CC=C3)/S2)C4=CC=CC=C4)/C#N |
Product Overview
(E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile (CAS 845903-72-2), with molecular formula C23H19N3O3S and molecular weight 417.11 g/mol. IUPAC: (2E)-2-[(5E)-5-benzylidene-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-3-morpholin-4-yl-3-oxopropanenitrile.
Chemical Property Profile of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile
Property Insights of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile
The XLogP value of 1.26088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile. The TPSA of 75.33 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile. Following Lipinski's Rule of Five, (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile?
The CAS number of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile is 845903-72-2.
What is the molecular formula of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile?
The molecular formula of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile is C23H19N3O3S.
What is the molecular weight of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile?
The molecular weight of (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile is 417.11 g/mol.
Where can I buy (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile?
You can request a quote for (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((E)-5-benzylidene-4-oxo-3-phenylthiazolidin-2-ylidene)-3-morpholino-3-oxopropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.