1Z-methoxy-2-pentyl-1,4-pentadiene
TL;DR: 1Z-methoxy-2-pentyl-1,4-pentadiene (CAS 4667-15-6) is a chemical compound with molecular formula C28H25NO2S and molecular weight 439.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[1-(4-methylphenyl)-4,6-diphenyl-2-pyridinylidene]-λ4-sulfanylidene]acetate
Also Known As: 1Z-methoxy-2-pentyl-1,4-pentadiene, 5a-Estran-3-one, 17b-hydroxy-2b,17-dimethyl- (7CI,8CI), 1-ethoxy-2-[1-(4-methylphenyl)-2,4-diphenyl-pyridin-6-yl]sulfanyl-ethenolate, 1-ethoxy-2-[1-(4-methylphenyl)-4,6-diphenylpyridin-1-ium-2-yl]sulfanylethenolate, Ethyl 2-[[1-(4-methylphenyl)-4,6-diphenylpyridin-2-ylidene]-lambda4-sulfanylidene]acetate
| Molecular Formula | C28H25NO2S |
|---|---|
| Molecular Weight | 439.16 g/mol |
| LogP | 6.75021 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.1606 |
| Heavy Atoms | 32 |
| Complexity | 1317.7286 |
Chemical Identifiers
| CAS Number | 4667-15-6 |
|---|---|
| SMILES | CCOC(=O)C=S=C1C=C(C=C(N1C2=CC=C(C=C2)C)C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
1Z-methoxy-2-pentyl-1,4-pentadiene (CAS 4667-15-6), with molecular formula C28H25NO2S and molecular weight 439.16 g/mol. IUPAC: ethyl 2-[[1-(4-methylphenyl)-4,6-diphenyl-2-pyridinylidene]-λ4-sulfanylidene]acetate.
Chemical Property Profile of 1Z-methoxy-2-pentyl-1,4-pentadiene
Property Insights of 1Z-methoxy-2-pentyl-1,4-pentadiene
The XLogP value of 6.75021 indicates that 1Z-methoxy-2-pentyl-1,4-pentadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.23 Ų, 1Z-methoxy-2-pentyl-1,4-pentadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1Z-methoxy-2-pentyl-1,4-pentadiene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1Z-methoxy-2-pentyl-1,4-pentadiene?
The CAS number of 1Z-methoxy-2-pentyl-1,4-pentadiene is 4667-15-6.
What is the molecular formula of 1Z-methoxy-2-pentyl-1,4-pentadiene?
The molecular formula of 1Z-methoxy-2-pentyl-1,4-pentadiene is C28H25NO2S.
What is the molecular weight of 1Z-methoxy-2-pentyl-1,4-pentadiene?
The molecular weight of 1Z-methoxy-2-pentyl-1,4-pentadiene is 439.16 g/mol.
Where can I buy 1Z-methoxy-2-pentyl-1,4-pentadiene?
You can request a quote for 1Z-methoxy-2-pentyl-1,4-pentadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1Z-methoxy-2-pentyl-1,4-pentadiene?
Yes, KEHONG BIO provides custom synthesis services for 1Z-methoxy-2-pentyl-1,4-pentadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.