4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone
TL;DR: 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone (CAS 100951-59-5) is a chemical compound with molecular formula C15H21N3OS and molecular weight 291.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-[(E)-(4-methoxyphenyl)methylideneamino]thiourea
Also Known As: 1-(4-methoxybenzylidene)-4-cyclohexylthiosemicarbazide, 4-methoxy-benzaldehyde-(4-cyclohexyl thiosemicarbazone), 1-cyclohexyl-3-[(4-methoxyphenyl)methylideneamino]thiourea, 4-METHOXYBENZALDEHYDE N-CYCLOHEXYLTHIOSEMICARBAZONE
| Molecular Formula | C15H21N3OS |
|---|---|
| Molecular Weight | 291.14 g/mol |
| LogP | 2.8259 |
| Topological Polar Surface Area | 45.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.14053 |
| Heavy Atoms | 20 |
| Complexity | 452.69135 |
Chemical Identifiers
| CAS Number | 100951-59-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=N/NC(=S)NC2CCCCC2 |
Product Overview
4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone (CAS 100951-59-5), with molecular formula C15H21N3OS and molecular weight 291.14 g/mol. IUPAC: 1-cyclohexyl-3-[(E)-(4-methoxyphenyl)methylideneamino]thiourea.
Chemical Property Profile of 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone
Property Insights of 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone
The XLogP value of 2.8259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone. With a topological polar surface area (TPSA) of 45.65 Ų, 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone 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 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone?
The CAS number of 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone is 100951-59-5.
What is the molecular formula of 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone?
The molecular formula of 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone is C15H21N3OS.
What is the molecular weight of 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone?
The molecular weight of 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone is 291.14 g/mol.
Where can I buy 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone?
You can request a quote for 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxybenzaldehyde N-cyclohexylthiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.