![[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate structure](/static/products/848/848332-64-9.png)
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate
TL;DR: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate (CAS 848332-64-9) is a chemical compound with molecular formula C27H29N3O5 and molecular weight 475.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoate
Also Known As: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate|[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoate|EN300-26681106
| Molecular Formula | C27H29N3O5 |
|---|---|
| Molecular Weight | 475.21 g/mol |
| LogP | 4.18878 |
| Topological Polar Surface Area | 108.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 475.21072 |
| Heavy Atoms | 35 |
| Complexity | 1128.2509 |
Chemical Identifiers
| CAS Number | 848332-64-9 |
|---|---|
| SMILES | CN(C(=O)COC(=O)C1=CC=CC=C1NC(=O)/C=C/C2=CC=C(C=C2)OC)C3(CCCCC3)C#N |
Product Overview
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate (CAS 848332-64-9), with molecular formula C27H29N3O5 and molecular weight 475.21 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoate.
Chemical Property Profile of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate
Property Insights of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate
The XLogP value of 4.18878 indicates that [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.73 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate. Following Lipinski's Rule of Five, [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate 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)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate?
The CAS number of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate is 848332-64-9.
What is the molecular formula of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate?
The molecular formula of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate is C27H29N3O5.
What is the molecular weight of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate?
The molecular weight of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate is 475.21 g/mol.
Where can I buy [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate?
You can request a quote for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]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 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate?
Yes, KEHONG BIO provides custom synthesis services for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[3-(4-methoxyphenyl)prop-2-enamido]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.