![tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate structure](/static/products/104/1042069-94-2.png)
tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate
TL;DR: tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate (CAS 1042069-94-2) is a chemical compound with molecular formula C19H29N3O5S and molecular weight 411.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 2-[1-(cyclohexanecarbonylcarbamothioyl)-3-oxopiperazin-2-yl]acetate
Also Known As: tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate, oxolan-2-ylmethyl 2-[1-(cyclohexanecarbonylcarbamothioyl)-3-oxopiperazin-2-yl]acetate, Oxolan-2-ylmethyl 2-[1-(cyclohexanecarbonylthiocarbamoyl)-3-oxo-piperazin-2-yl]acetate, tetrahydrofuran-2-ylmethyl {1-[(cyclohexylcarbonyl)carbamothioyl]-3-oxopiperazin-2-yl}acetate
| Molecular Formula | C19H29N3O5S |
|---|---|
| Molecular Weight | 411.18 g/mol |
| LogP | 0.8805 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.1828 |
| Heavy Atoms | 28 |
| Complexity | 602.3765 |
Chemical Identifiers
| CAS Number | 1042069-94-2 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)NC(=S)N2CCNC(=O)C2CC(=O)OCC3CCCO3 |
Product Overview
tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate (CAS 1042069-94-2), with molecular formula C19H29N3O5S and molecular weight 411.18 g/mol. IUPAC: oxolan-2-ylmethyl 2-[1-(cyclohexanecarbonylcarbamothioyl)-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate
Property Insights of tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate
The XLogP value of 0.8805 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate. Following Lipinski's Rule of Five, tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate has 2 hydrogen bond donor(s) and 6 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 tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate?
The CAS number of tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate is 1042069-94-2.
What is the molecular formula of tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate?
The molecular formula of tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate is C19H29N3O5S.
What is the molecular weight of tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate?
The molecular weight of tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate is 411.18 g/mol.
Where can I buy tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate?
You can request a quote for tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for tetrahydro-2-furanylmethyl (1-{[(cyclohexylcarbonyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.