Benzaldehyde 4-phenylthiosemicarbazone
TL;DR: Benzaldehyde 4-phenylthiosemicarbazone (CAS 13456-63-8) is a chemical compound with molecular formula C14H13N3S and molecular weight 255.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzylideneamino)-3-phenylthiourea
Also Known As: benzaldehyde 4-phenylthiosemicarbazone, 1-(benzylideneamino)-3-phenylthiourea, HYDRAZINECARBOTHIOAMIDE,N-PHENYL-2-(PHENYLMETHYLENE)-
| Molecular Formula | C14H13N3S |
|---|---|
| Molecular Weight | 255.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.08302 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 13456-63-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=NNC(=S)NC2=CC=CC=C2 |
| InChIKey | AXBWEHNBWRHZBB-UHFFFAOYSA-N |
Product Overview
Benzaldehyde 4-phenylthiosemicarbazone (CAS 13456-63-8), with molecular formula C14H13N3S and molecular weight 255.08 g/mol. IUPAC: 1-(benzylideneamino)-3-phenylthiourea.
Chemical Property Profile of Benzaldehyde 4-phenylthiosemicarbazone
Property Insights of Benzaldehyde 4-phenylthiosemicarbazone
The XLogP value of 3.2 indicates that Benzaldehyde 4-phenylthiosemicarbazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzaldehyde 4-phenylthiosemicarbazone. Following Lipinski's Rule of Five, Benzaldehyde 4-phenylthiosemicarbazone 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 Benzaldehyde 4-phenylthiosemicarbazone?
The CAS number of Benzaldehyde 4-phenylthiosemicarbazone is 13456-63-8.
What is the molecular formula of Benzaldehyde 4-phenylthiosemicarbazone?
The molecular formula of Benzaldehyde 4-phenylthiosemicarbazone is C14H13N3S.
What is the molecular weight of Benzaldehyde 4-phenylthiosemicarbazone?
The molecular weight of Benzaldehyde 4-phenylthiosemicarbazone is 255.08 g/mol.
Where can I buy Benzaldehyde 4-phenylthiosemicarbazone?
You can request a quote for Benzaldehyde 4-phenylthiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde 4-phenylthiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde 4-phenylthiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.