RefChem:489082
TL;DR: RefChem:489082 (CAS 381200-79-9) is a chemical compound with molecular formula C25H31N5O2S2 and molecular weight 497.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-cyclohexyl-5-[[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AS-871/41114558, (5Z)-3-cyclohexyl-5-[[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-3-cyclohexyl-5-((2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, 3-[(Z)-(3-CYCLOHEXYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-2-(4-ETHYL-1-PIPERAZINYL)-9-METHYL-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE, 3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(4-ethylpiperazin-1-yl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C25H31N5O2S2 |
|---|---|
| Molecular Weight | 497.19 g/mol |
| LogP | 3.67872 |
| Topological Polar Surface Area | 61.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 497.19193 |
| Heavy Atoms | 34 |
| Complexity | 1209.7429 |
Chemical Identifiers
| CAS Number | 381200-79-9 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C\4/C(=O)N(C(=S)S4)C5CCCCC5 |
Product Overview
RefChem:489082 (CAS 381200-79-9), with molecular formula C25H31N5O2S2 and molecular weight 497.19 g/mol. IUPAC: (5Z)-3-cyclohexyl-5-[[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:489082
Property Insights of RefChem:489082
The XLogP value of 3.67872 indicates that RefChem:489082 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.16 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:489082. Following Lipinski's Rule of Five, RefChem:489082 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:489082?
The CAS number of RefChem:489082 is 381200-79-9.
What is the molecular formula of RefChem:489082?
The molecular formula of RefChem:489082 is C25H31N5O2S2.
What is the molecular weight of RefChem:489082?
The molecular weight of RefChem:489082 is 497.19 g/mol.
Where can I buy RefChem:489082?
You can request a quote for RefChem:489082 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:489082?
Yes, KEHONG BIO provides custom synthesis services for RefChem:489082 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.