7-Iodobenzovesamicol
TL;DR: 7-Iodobenzovesamicol (CAS 156558-61-1) is a chemical compound with molecular formula C21H24INO and molecular weight 433.09027 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R)-7-iodo-3-(4-phenylpiperidin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-ol
Also Known As: 7-Iodobenzovesamicol, 7-Ibvm, (2S,3R)-7-iodo-3-(4-phenylpiperidin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-ol, (2S-cis)-1,2,3,4-Tetrahydro-7-iodo-3-(4-phenyl-1-piperdinyl)-2-naphthalenol, 1,2,3,4-Tetrahydro-7-iodo-3-(4-phenyl-1-piperdinyl)-2-naphthalenol (2S-cis)-
Technical Specifications
| Molecular Formula | C21H24INO |
| Molecular Weight | 433.09027 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 433.09027 Da |
| Heavy Atoms | 24 |
| Complexity | 403.0 |
| SMILES | C1CN(CCC1C2=CC=CC=C2)[C@@H]3CC4=C(C[C@@H]3O)C=C(C=C4)I |
| InChIKey | MTVLLGKCGSPPQQ-RTWAWAEBSA-N |
Chemical Property Profile of 7-Iodobenzovesamicol
Property Insights of 7-Iodobenzovesamicol
The XLogP value of 4.6 indicates that 7-Iodobenzovesamicol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 7-Iodobenzovesamicol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Iodobenzovesamicol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-Iodobenzovesamicol?
The CAS number of 7-Iodobenzovesamicol is 156558-61-1.
What is the molecular formula of 7-Iodobenzovesamicol?
The molecular formula of 7-Iodobenzovesamicol is C21H24INO.
What is the molecular weight of 7-Iodobenzovesamicol?
The molecular weight of 7-Iodobenzovesamicol is 433.09027 g/mol.
Where can I buy 7-Iodobenzovesamicol?
You can request a quote for 7-Iodobenzovesamicol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-Iodobenzovesamicol?
Yes, CoreyChem provides custom synthesis services for 7-Iodobenzovesamicol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.