![[(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea structure](/static/products/861/861316-71-4.png)
[(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea
TL;DR: [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea (CAS 861316-71-4) is a chemical compound with molecular formula C8H13N3S and molecular weight 183.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3-methylcyclohex-2-en-1-ylidene)amino]thiourea
Also Known As: [(3-methylcyclohex-2-en-1-ylidene)amino]thiourea, [(3-methyl-1-cyclohex-2-enylidene)amino]thiourea, amino((aza(3-methylcyclohex-2-enylidene)methyl)amino)methane-1-thione
| Molecular Formula | C8H13N3S |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 1.3058 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.08302 |
| Heavy Atoms | 12 |
| Complexity | 242.68753 |
Chemical Identifiers
| CAS Number | 861316-71-4 |
|---|---|
| SMILES | CC1=CC(=NNC(=S)N)CCC1 |
Product Overview
[(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea (CAS 861316-71-4), with molecular formula C8H13N3S and molecular weight 183.08 g/mol. IUPAC: [(3-methylcyclohex-2-en-1-ylidene)amino]thiourea.
Chemical Property Profile of [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea
Property Insights of [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea
The XLogP value of 1.3058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea. With a topological polar surface area (TPSA) of 50.41 Ų, [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea 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 [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea?
The CAS number of [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea is 861316-71-4.
What is the molecular formula of [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea?
The molecular formula of [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea is C8H13N3S.
What is the molecular weight of [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea?
The molecular weight of [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea is 183.08 g/mol.
Where can I buy [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea?
You can request a quote for [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(3-Methylcyclohex-2-en-1-ylidene)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.