5-Iodovanillin semicarbazone
TL;DR: 5-Iodovanillin semicarbazone (CAS 73664-56-9) is a chemical compound with molecular formula C9H10IN3O3 and molecular weight 334.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-hydroxy-3-iodo-5-methoxyphenyl)methylideneamino]urea
Also Known As: 5-Iodovanillin semicarbazone, 2-[(E)-(3-Iodo-5-methoxy-4-oxo-2,5-cyclohexadien-1-ylidene)m
| Molecular Formula | C9H10IN3O3 |
|---|---|
| Molecular Weight | 334.98 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 96.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.97668 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 73664-56-9 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=NNC(=O)N)I)O |
| InChIKey | JMASRTLJHMFKEI-UHFFFAOYSA-N |
Product Overview
5-Iodovanillin semicarbazone (CAS 73664-56-9), with molecular formula C9H10IN3O3 and molecular weight 334.98 g/mol. IUPAC: [(4-hydroxy-3-iodo-5-methoxyphenyl)methylideneamino]urea.
Chemical Property Profile of 5-Iodovanillin semicarbazone
Property Insights of 5-Iodovanillin semicarbazone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Iodovanillin semicarbazone. The TPSA of 96.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Iodovanillin semicarbazone. Following Lipinski's Rule of Five, 5-Iodovanillin semicarbazone has 3 hydrogen bond donor(s) and 4 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 5-Iodovanillin semicarbazone?
The CAS number of 5-Iodovanillin semicarbazone is 73664-56-9.
What is the molecular formula of 5-Iodovanillin semicarbazone?
The molecular formula of 5-Iodovanillin semicarbazone is C9H10IN3O3.
What is the molecular weight of 5-Iodovanillin semicarbazone?
The molecular weight of 5-Iodovanillin semicarbazone is 334.98 g/mol.
Where can I buy 5-Iodovanillin semicarbazone?
You can request a quote for 5-Iodovanillin semicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Iodovanillin semicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 5-Iodovanillin semicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.