Anisaldehyde, thiosemicarbazone
TL;DR: Anisaldehyde, thiosemicarbazone (CAS 219712-86-4) is a chemical compound with molecular formula C9H11N3OS and molecular weight 209.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(4-methoxyphenyl)methylideneamino]thiourea
Also Known As: Anisaldehyde thiosemicarbazone, 4-Methoxybenzaldehyde thiosemicarbazone, Anisaldehyde, thiosemicarbazone, {[(4-methoxyphenyl)methylidene]amino}thiourea, p-Anisaldehyde, thiosemicarbazone
| Molecular Formula | C9H11N3OS |
|---|---|
| Molecular Weight | 209.06 g/mol |
| LogP | 0.8623 |
| Topological Polar Surface Area | 59.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.06229 |
| Heavy Atoms | 14 |
| Complexity | 334.41522 |
Chemical Identifiers
| CAS Number | 219712-86-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=N/NC(=S)N |
Product Overview
Anisaldehyde, thiosemicarbazone (CAS 219712-86-4), with molecular formula C9H11N3OS and molecular weight 209.06 g/mol. IUPAC: [(E)-(4-methoxyphenyl)methylideneamino]thiourea.
Chemical Property Profile of Anisaldehyde, thiosemicarbazone
Property Insights of Anisaldehyde, thiosemicarbazone
The XLogP value of 0.8623 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Anisaldehyde, thiosemicarbazone. With a topological polar surface area (TPSA) of 59.64 Ų, Anisaldehyde, thiosemicarbazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anisaldehyde, thiosemicarbazone has 2 hydrogen bond donor(s) and 3 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 Anisaldehyde, thiosemicarbazone?
The CAS number of Anisaldehyde, thiosemicarbazone is 219712-86-4.
What is the molecular formula of Anisaldehyde, thiosemicarbazone?
The molecular formula of Anisaldehyde, thiosemicarbazone is C9H11N3OS.
What is the molecular weight of Anisaldehyde, thiosemicarbazone?
The molecular weight of Anisaldehyde, thiosemicarbazone is 209.06 g/mol.
Where can I buy Anisaldehyde, thiosemicarbazone?
You can request a quote for Anisaldehyde, thiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anisaldehyde, thiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for Anisaldehyde, thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.