RefChem:488845
TL;DR: RefChem:488845 (CAS 324566-58-7) is a chemical compound with molecular formula C18H19N5O2S2 and molecular weight 401.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-methyl-5-[[2-(4-methylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 03538404, 3-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(4-methyl-1-piperazinyl)-4H-pyrido[1,2-a]pyrimidin-4-one, (5E)-3-methyl-5-[[2-(4-methylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 3-((E)-(3-Methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl)-2-(4-methyl-1-piperazinyl)-4H-pyrido(1,2-A)pyrimidin-4-one, 643-840-9
| Molecular Formula | C18H19N5O2S2 |
|---|---|
| Molecular Weight | 401.10 g/mol |
| LogP | 1.2773 |
| Topological Polar Surface Area | 61.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 401.09802 |
| Heavy Atoms | 27 |
| Complexity | 1024.0742 |
Chemical Identifiers
| CAS Number | 324566-58-7 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)/C=C/4\C(=O)N(C(=S)S4)C |
Product Overview
RefChem:488845 (CAS 324566-58-7), with molecular formula C18H19N5O2S2 and molecular weight 401.10 g/mol. IUPAC: (5E)-3-methyl-5-[[2-(4-methylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:488845
Property Insights of RefChem:488845
The XLogP value of 1.2773 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:488845. The TPSA of 61.16 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:488845. Following Lipinski's Rule of Five, RefChem:488845 has 0 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:488845?
The CAS number of RefChem:488845 is 324566-58-7.
What is the molecular formula of RefChem:488845?
The molecular formula of RefChem:488845 is C18H19N5O2S2.
What is the molecular weight of RefChem:488845?
The molecular weight of RefChem:488845 is 401.10 g/mol.
Where can I buy RefChem:488845?
You can request a quote for RefChem:488845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:488845?
Yes, KEHONG BIO provides custom synthesis services for RefChem:488845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.