RefChem:489056
TL;DR: RefChem:489056 (CAS 378780-12-2) is a chemical compound with molecular formula C25H20N4O3S2 and molecular weight 488.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-benzyl-5-[[2-(furan-2-ylmethylamino)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(2-furylmethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one, (Z)-3-benzyl-5-((2-((furan-2-ylmethyl)amino)-7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, (5Z)-3-BENZYL-5-[(2-{[(FURAN-2-YL)METHYL]AMINO}-7-METHYL-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL)METHYLIDENE]-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (5Z)-3-benzyl-5-[[2-(furan-2-ylmethylamino)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 3-((Z)-(3-Benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl)-2-((2-furylmethyl)amino)-7-methyl-4H-pyrido(1,2-A)pyrimidin-4-one
| Molecular Formula | C25H20N4O3S2 |
|---|---|
| Molecular Weight | 488.10 g/mol |
| LogP | 4.60942 |
| Topological Polar Surface Area | 79.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 488.0977 |
| Heavy Atoms | 34 |
| Complexity | 1477.5806 |
Chemical Identifiers
| CAS Number | 378780-12-2 |
|---|---|
| SMILES | CC1=CN2C(=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)CC4=CC=CC=C4)NCC5=CC=CO5)C=C1 |
Product Overview
RefChem:489056 (CAS 378780-12-2), with molecular formula C25H20N4O3S2 and molecular weight 488.10 g/mol. IUPAC: (5Z)-3-benzyl-5-[[2-(furan-2-ylmethylamino)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:489056
Property Insights of RefChem:489056
The XLogP value of 4.60942 indicates that RefChem:489056 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.85 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:489056. Following Lipinski's Rule of Five, RefChem:489056 has 1 hydrogen bond donor(s) and 7 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:489056?
The CAS number of RefChem:489056 is 378780-12-2.
What is the molecular formula of RefChem:489056?
The molecular formula of RefChem:489056 is C25H20N4O3S2.
What is the molecular weight of RefChem:489056?
The molecular weight of RefChem:489056 is 488.10 g/mol.
Where can I buy RefChem:489056?
You can request a quote for RefChem:489056 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:489056?
Yes, KEHONG BIO provides custom synthesis services for RefChem:489056 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.