RefChem:489059
TL;DR: RefChem:489059 (CAS 374616-74-7) is a chemical compound with molecular formula C25H25N5O3S2 and molecular weight 507.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-benzyl-5-[[2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (Z)-3-benzyl-5-((2-(4-(2-hydroxyethyl)piperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, 3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-hydroxyethyl)-1-piperazinyl]-4H-pyrido[1,2-a]pyrimidin-4-one, (5Z)-3-BENZYL-5-({2-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL}METHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (5Z)-3-benzyl-5-[[2-[4-(2-hydroxyethyl)piperazin-1-yl]-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-(4-(2-hydroxyethyl)-1-piperazinyl)-4H-pyrido(1,2-A)pyrimidin-4-one
| Molecular Formula | C25H25N5O3S2 |
|---|---|
| Molecular Weight | 507.14 g/mol |
| LogP | 2.2102 |
| Topological Polar Surface Area | 81.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 507.1399 |
| Heavy Atoms | 35 |
| Complexity | 1350.2145 |
Chemical Identifiers
| CAS Number | 374616-74-7 |
|---|---|
| SMILES | C1CN(CCN1CCO)C2=C(C(=O)N3C=CC=CC3=N2)/C=C\4/C(=O)N(C(=S)S4)CC5=CC=CC=C5 |
Product Overview
RefChem:489059 (CAS 374616-74-7), with molecular formula C25H25N5O3S2 and molecular weight 507.14 g/mol. IUPAC: (5Z)-3-benzyl-5-[[2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:489059
Property Insights of RefChem:489059
The XLogP value of 2.2102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:489059. The TPSA of 81.39 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:489059. Following Lipinski's Rule of Five, RefChem:489059 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:489059?
The CAS number of RefChem:489059 is 374616-74-7.
What is the molecular formula of RefChem:489059?
The molecular formula of RefChem:489059 is C25H25N5O3S2.
What is the molecular weight of RefChem:489059?
The molecular weight of RefChem:489059 is 507.14 g/mol.
Where can I buy RefChem:489059?
You can request a quote for RefChem:489059 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:489059?
Yes, KEHONG BIO provides custom synthesis services for RefChem:489059 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.