![[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate structure](/static/products/874/874636-87-0.png)
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate
TL;DR: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate (CAS 874636-87-0) is a chemical compound with molecular formula C23H27N3O5 and molecular weight 425.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate
Also Known As: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate|[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate|EN300-26681277
| Molecular Formula | C23H27N3O5 |
|---|---|
| Molecular Weight | 425.20 g/mol |
| LogP | 3.71212 |
| Topological Polar Surface Area | 105.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.19507 |
| Heavy Atoms | 31 |
| Complexity | 948.58844 |
Chemical Identifiers
| CAS Number | 874636-87-0 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)COC2=CC=C(C=C2)C(=O)OCC(=O)N(C)C3(CCCCC3)C#N |
Product Overview
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate (CAS 874636-87-0), with molecular formula C23H27N3O5 and molecular weight 425.20 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate.
Chemical Property Profile of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate
Property Insights of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate
The XLogP value of 3.71212 indicates that [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.66 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate. Following Lipinski's Rule of Five, [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate has 0 hydrogen bond donor(s) and 7 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)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate?
The CAS number of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate is 874636-87-0.
What is the molecular formula of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate?
The molecular formula of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate is C23H27N3O5.
What is the molecular weight of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate?
The molecular weight of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate is 425.20 g/mol.
Where can I buy [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate?
You can request a quote for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.