![[(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate structure](/static/products/876/876669-38-4.png)
[(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate
TL;DR: [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate (CAS 876669-38-4) is a chemical compound with molecular formula C14H18N2O5 and molecular weight 294.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate
Also Known As: [(1-cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate|[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate|MLS002164118|SMR001246494|EN300-26685434
| Molecular Formula | C14H18N2O5 |
|---|---|
| Molecular Weight | 294.12 g/mol |
| LogP | 0.76048 |
| Topological Polar Surface Area | 97.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.12158 |
| Heavy Atoms | 21 |
| Complexity | 474.24628 |
Chemical Identifiers
| CAS Number | 876669-38-4 |
|---|---|
| SMILES | C1CCC(CC1)(C#N)NC(=O)COC(=O)C2=COCCO2 |
Product Overview
[(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate (CAS 876669-38-4), with molecular formula C14H18N2O5 and molecular weight 294.12 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate.
Chemical Property Profile of [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate
Property Insights of [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate
The XLogP value of 0.76048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate. The TPSA of 97.65 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate. Following Lipinski's Rule of Five, [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate has 1 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 [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate?
The CAS number of [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate is 876669-38-4.
What is the molecular formula of [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate?
The molecular formula of [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate is C14H18N2O5.
What is the molecular weight of [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate?
The molecular weight of [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate is 294.12 g/mol.
Where can I buy [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate?
You can request a quote for [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(1-Cyanocyclohexyl)carbamoyl]methyl 5,6-dihydro-1,4-dioxine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.