N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide
TL;DR: N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide (CAS 331461-65-5) is a chemical compound with molecular formula C9H18N4S2 and molecular weight 246.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-(methylcarbamothioylamino)thiourea
Also Known As: N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide, 1-[(cyclohexylcarbamothioyl)amino]-3-methylthiourea, 1-cyclohexyl-3-(methylcarbamothioylamino)thiourea, 1-cyclohexyl-3-[(methylcarbamothioyl)amino]thiourea
| Molecular Formula | C9H18N4S2 |
|---|---|
| Molecular Weight | 246.10 g/mol |
| LogP | 0.7921 |
| Topological Polar Surface Area | 48.12 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.09729 |
| Heavy Atoms | 15 |
| Complexity | 226.15224 |
Chemical Identifiers
| CAS Number | 331461-65-5 |
|---|---|
| SMILES | CNC(=S)NNC(=S)NC1CCCCC1 |
Product Overview
N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide (CAS 331461-65-5), with molecular formula C9H18N4S2 and molecular weight 246.10 g/mol. IUPAC: 1-cyclohexyl-3-(methylcarbamothioylamino)thiourea.
Chemical Property Profile of N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide
Property Insights of N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide
The XLogP value of 0.7921 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide. With a topological polar surface area (TPSA) of 48.12 Ų, N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide has 4 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 N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide?
The CAS number of N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide is 331461-65-5.
What is the molecular formula of N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide?
The molecular formula of N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide is C9H18N4S2.
What is the molecular weight of N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide?
The molecular weight of N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide is 246.10 g/mol.
Where can I buy N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide?
You can request a quote for N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N~1~-cyclohexyl-N~2~-methyl-1,2-hydrazinedicarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.