RefChem:454740
TL;DR: RefChem:454740 (CAS 618073-16-8) is a chemical compound with molecular formula C23H28N4O3S2 and molecular weight 472.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[2-(3,5-dimethylpiperidin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 2-(3,5-DIMETHYL-1-PIPERIDINYL)-3-{(Z)-[3-(2-METHOXYETHYL)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}-9-METHYL-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE, (5Z)-5-[[2-(3,5-dimethylpiperidin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 2-(3,5-DIMETHYL-1-PIPERIDINYL)-3-((Z)-(3-(2-METHOXYETHYL)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL)-9-METHYL-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE, 2-(3,5-dimethylpiperidin-1-yl)-3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one, 5-{[2-(3,5-dimethylpiperidyl)-9-methyl-4-oxo(5-hydropyridino[1,2-a]pyrimidin-3 -yl)]methylene}-3-(2-methoxyethyl)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C23H28N4O3S2 |
|---|---|
| Molecular Weight | 472.16 g/mol |
| LogP | 3.33282 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.16028 |
| Heavy Atoms | 32 |
| Complexity | 1149.8711 |
Chemical Identifiers
| CAS Number | 618073-16-8 |
|---|---|
| SMILES | CC1CC(CN(C1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C\4/C(=O)N(C(=S)S4)CCOC)C |
Product Overview
RefChem:454740 (CAS 618073-16-8), with molecular formula C23H28N4O3S2 and molecular weight 472.16 g/mol. IUPAC: (5Z)-5-[[2-(3,5-dimethylpiperidin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:454740
Property Insights of RefChem:454740
The XLogP value of 3.33282 indicates that RefChem:454740 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.15 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:454740. Following Lipinski's Rule of Five, RefChem:454740 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:454740?
The CAS number of RefChem:454740 is 618073-16-8.
What is the molecular formula of RefChem:454740?
The molecular formula of RefChem:454740 is C23H28N4O3S2.
What is the molecular weight of RefChem:454740?
The molecular weight of RefChem:454740 is 472.16 g/mol.
Where can I buy RefChem:454740?
You can request a quote for RefChem:454740 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:454740?
Yes, KEHONG BIO provides custom synthesis services for RefChem:454740 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.