RefChem:460429
TL;DR: RefChem:460429 (CAS 618078-16-3) is a chemical compound with molecular formula C26H26N4O2S2 and molecular weight 490.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[2-(cyclohexylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 2-(cyclohexylamino)-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one, (5Z)-5-[[2-(cyclohexylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one, 2-(CYCLOHEXYLAMINO)-3-((Z)-(4-OXO-3-(2-PHENYLETHYL)-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL)-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE, 647-161-9, RefChem:460429
| Molecular Formula | C26H26N4O2S2 |
|---|---|
| Molecular Weight | 490.15 g/mol |
| LogP | 4.883 |
| Topological Polar Surface Area | 66.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 490.14972 |
| Heavy Atoms | 34 |
| Complexity | 1313.3752 |
Chemical Identifiers
| CAS Number | 618078-16-3 |
|---|---|
| SMILES | C1CCC(CC1)NC2=C(C(=O)N3C=CC=CC3=N2)/C=C\4/C(=O)N(C(=S)S4)CCC5=CC=CC=C5 |
Product Overview
RefChem:460429 (CAS 618078-16-3), with molecular formula C26H26N4O2S2 and molecular weight 490.15 g/mol. IUPAC: (5Z)-5-[[2-(cyclohexylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:460429
Property Insights of RefChem:460429
The XLogP value of 4.883 indicates that RefChem:460429 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.71 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:460429. Following Lipinski's Rule of Five, RefChem:460429 has 1 hydrogen bond donor(s) and 6 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 RefChem:460429?
The CAS number of RefChem:460429 is 618078-16-3.
What is the molecular formula of RefChem:460429?
The molecular formula of RefChem:460429 is C26H26N4O2S2.
What is the molecular weight of RefChem:460429?
The molecular weight of RefChem:460429 is 490.15 g/mol.
Where can I buy RefChem:460429?
You can request a quote for RefChem:460429 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:460429?
Yes, KEHONG BIO provides custom synthesis services for RefChem:460429 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.