Phenyl acetaldehyde thiosemicarbazone
TL;DR: Phenyl acetaldehyde thiosemicarbazone (CAS 7420-49-7) is a chemical compound with molecular formula C9H11N3S and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-phenylethylideneamino)thiourea
Also Known As: (phenethylideneamino)thiourea, NCIOpen2_000660, phenylacetaldehyde thiosemicarbazone, phenyl acetaldehyde thiosemicarbazone, HYDRAZINECARBOTHIOAMIDE,2-(2-PHENYLETHYLIDENE)-
| Molecular Formula | C9H11N3S |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 1.0481 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.06737 |
| Heavy Atoms | 13 |
| Complexity | 294.98795 |
Chemical Identifiers
| CAS Number | 7420-49-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC=NNC(=S)N |
Product Overview
Phenyl acetaldehyde thiosemicarbazone (CAS 7420-49-7), with molecular formula C9H11N3S and molecular weight 193.07 g/mol. IUPAC: (2-phenylethylideneamino)thiourea.
Chemical Property Profile of Phenyl acetaldehyde thiosemicarbazone
Property Insights of Phenyl acetaldehyde thiosemicarbazone
The XLogP value of 1.0481 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl acetaldehyde thiosemicarbazone. With a topological polar surface area (TPSA) of 50.41 Ų, Phenyl acetaldehyde thiosemicarbazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl acetaldehyde thiosemicarbazone has 2 hydrogen bond donor(s) and 2 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 Phenyl acetaldehyde thiosemicarbazone?
The CAS number of Phenyl acetaldehyde thiosemicarbazone is 7420-49-7.
What is the molecular formula of Phenyl acetaldehyde thiosemicarbazone?
The molecular formula of Phenyl acetaldehyde thiosemicarbazone is C9H11N3S.
What is the molecular weight of Phenyl acetaldehyde thiosemicarbazone?
The molecular weight of Phenyl acetaldehyde thiosemicarbazone is 193.07 g/mol.
Where can I buy Phenyl acetaldehyde thiosemicarbazone?
You can request a quote for Phenyl acetaldehyde thiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl acetaldehyde thiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for Phenyl acetaldehyde thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.