![2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid structure](/static/products/5436/543695-36-9.webp)
2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid
TL;DR: 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid (CAS 543695-36-9) is a chemical compound with molecular formula C9H15N3O3S and molecular weight 245.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid
Also Known As: 2-[(carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid, AN-329/41402626, 2-{[2-(aminocarbothioyl)hydrazino]carbonyl}cyclohexanecarboxylic acid
| Molecular Formula | C9H15N3O3S |
|---|---|
| Molecular Weight | 245.08 g/mol |
| LogP | -0.2582 |
| Topological Polar Surface Area | 104.45 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.08342 |
| Heavy Atoms | 16 |
| Complexity | 308.37433 |
Chemical Identifiers
| CAS Number | 543695-36-9 |
|---|---|
| SMILES | C1CCC(C(C1)C(=O)NNC(=S)N)C(=O)O |
Product Overview
2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid (CAS 543695-36-9), with molecular formula C9H15N3O3S and molecular weight 245.08 g/mol. IUPAC: 2-[(carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid
Property Insights of 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid
The XLogP value of -0.2582 indicates that 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid. Following Lipinski's Rule of Five, 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid has 4 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 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid?
The CAS number of 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid is 543695-36-9.
What is the molecular formula of 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid?
The molecular formula of 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid is C9H15N3O3S.
What is the molecular weight of 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid?
The molecular weight of 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid is 245.08 g/mol.
Where can I buy 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid?
You can request a quote for 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Carbamothioylamino)carbamoyl]cyclohexane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.