2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide
TL;DR: 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide (CAS 5515-70-8) 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.
(cyclohex-3-en-1-ylmethylideneamino)thiourea
Also Known As: (cyclohex-3-en-1-ylmethylideneamino)thiourea, 2-(cyclohex-3-enylmethylene)hydrazinecarbothioamide, 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide, 2-[(Cyclohex-3-en-1-yl)methylidene]hydrazine-1-carbothioamide, RefChem:251512
| Molecular Formula | C8H13N3S |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 1.1617 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.08302 |
| Heavy Atoms | 12 |
| Complexity | 210.34851 |
Chemical Identifiers
| CAS Number | 5515-70-8 |
|---|---|
| SMILES | C1CC(CC=C1)C=NNC(=S)N |
Product Overview
2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide (CAS 5515-70-8), with molecular formula C8H13N3S and molecular weight 183.08 g/mol. IUPAC: (cyclohex-3-en-1-ylmethylideneamino)thiourea.
Chemical Property Profile of 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide
Property Insights of 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide
The XLogP value of 1.1617 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide. With a topological polar surface area (TPSA) of 50.41 Ų, 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide 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 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide?
The CAS number of 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide is 5515-70-8.
What is the molecular formula of 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide?
The molecular formula of 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide is C8H13N3S.
What is the molecular weight of 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide?
The molecular weight of 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide is 183.08 g/mol.
Where can I buy 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide?
You can request a quote for 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Cyclohexen-1-ylmethylene)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.