RefChem:489048
TL;DR: RefChem:489048 (CAS 618073-18-0) is a chemical compound with molecular formula C23H26N4O2S2 and molecular weight 454.15 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-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-[(Z)-(3-ALLYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-2-(3,5-DIMETHYL-1-PIPERIDINYL)-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-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one, 2-(3,5-dimethylpiperidin-1-yl)-9-methyl-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one, 3-((Z)-(3-Allyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl)-2-(3,5-dimethyl-1-piperidinyl)-9-methyl-4H-pyrido(1,2-A)pyrimidin-4-one, 637-832-4
| Molecular Formula | C23H26N4O2S2 |
|---|---|
| Molecular Weight | 454.15 g/mol |
| LogP | 3.87242 |
| Topological Polar Surface Area | 57.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.14972 |
| Heavy Atoms | 31 |
| Complexity | 1160.1111 |
Chemical Identifiers
| CAS Number | 618073-18-0 |
|---|---|
| SMILES | CC1CC(CN(C1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C\4/C(=O)N(C(=S)S4)CC=C)C |
Product Overview
RefChem:489048 (CAS 618073-18-0), with molecular formula C23H26N4O2S2 and molecular weight 454.15 g/mol. IUPAC: (5Z)-5-[[2-(3,5-dimethylpiperidin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:489048
Property Insights of RefChem:489048
The XLogP value of 3.87242 indicates that RefChem:489048 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.92 Ų, RefChem:489048 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:489048 has 0 hydrogen bond donor(s) and 6 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:489048?
The CAS number of RefChem:489048 is 618073-18-0.
What is the molecular formula of RefChem:489048?
The molecular formula of RefChem:489048 is C23H26N4O2S2.
What is the molecular weight of RefChem:489048?
The molecular weight of RefChem:489048 is 454.15 g/mol.
Where can I buy RefChem:489048?
You can request a quote for RefChem:489048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:489048?
Yes, KEHONG BIO provides custom synthesis services for RefChem:489048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.