[2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate
TL;DR: [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate (CAS 875466-00-5) is a chemical compound with molecular formula C17H21N3O6 and molecular weight 363.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate
Also Known As: [2-(cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate|2-[(cyclohexylcarbamoyl)amino]-2-oxoethyl 2-methyl-3-nitrobenzoate|MLS002251566|SMR001313956
| Molecular Formula | C17H21N3O6 |
|---|---|
| Molecular Weight | 363.14 g/mol |
| LogP | 2.21852 |
| Topological Polar Surface Area | 127.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.14304 |
| Heavy Atoms | 26 |
| Complexity | 712.4498 |
Chemical Identifiers
| CAS Number | 875466-00-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC(=O)NC(=O)NC2CCCCC2 |
Product Overview
[2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate (CAS 875466-00-5), with molecular formula C17H21N3O6 and molecular weight 363.14 g/mol. IUPAC: [2-(cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate.
Chemical Property Profile of [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate
Property Insights of [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate
The XLogP value of 2.21852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate. The TPSA of 127.64 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate. Following Lipinski's Rule of Five, [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate 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 [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate?
The CAS number of [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate is 875466-00-5.
What is the molecular formula of [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate?
The molecular formula of [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate is C17H21N3O6.
What is the molecular weight of [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate?
The molecular weight of [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate is 363.14 g/mol.
Where can I buy [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate?
You can request a quote for [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.