RefChem:456741
TL;DR: RefChem:456741 (CAS 372979-30-1) is a chemical compound with molecular formula C26H27N5O3S2 and molecular weight 521.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 2-(4-benzylpiperazin-1-yl)-3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one, 2-(4-BENZYL-1-PIPERAZINYL)-3-{(Z)-[3-(2-METHOXYETHYL)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE, (5Z)-5-[[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-{[2-(4-BENZYLPIPERAZIN-1-YL)-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]METHYLIDENE}-3-(2-METHOXYETHYL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (Z)-5-((2-(4-benzylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-(2-methoxyethyl)-2-thioxothiazolidin-4-one
| Molecular Formula | C26H27N5O3S2 |
|---|---|
| Molecular Weight | 521.16 g/mol |
| LogP | 2.8643 |
| Topological Polar Surface Area | 70.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.1555 |
| Heavy Atoms | 36 |
| Complexity | 1367.0023 |
Chemical Identifiers
| CAS Number | 372979-30-1 |
|---|---|
| SMILES | COCCN1C(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)CC5=CC=CC=C5)/SC1=S |
Product Overview
RefChem:456741 (CAS 372979-30-1), with molecular formula C26H27N5O3S2 and molecular weight 521.16 g/mol. IUPAC: (5Z)-5-[[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:456741
Property Insights of RefChem:456741
The XLogP value of 2.8643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:456741. The TPSA of 70.39 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:456741. Following Lipinski's Rule of Five, RefChem:456741 has 0 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:456741?
The CAS number of RefChem:456741 is 372979-30-1.
What is the molecular formula of RefChem:456741?
The molecular formula of RefChem:456741 is C26H27N5O3S2.
What is the molecular weight of RefChem:456741?
The molecular weight of RefChem:456741 is 521.16 g/mol.
Where can I buy RefChem:456741?
You can request a quote for RefChem:456741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:456741?
Yes, KEHONG BIO provides custom synthesis services for RefChem:456741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.