![[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate structure](/static/products/852/852906-60-6.png)
[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate
TL;DR: [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate (CAS 852906-60-6) is a chemical compound with molecular formula C24H29N3O8 and molecular weight 487.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate
Also Known As: [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate|[methyl-[(2,3,4-trimethoxyphenyl)methyl]carbamoyl]methyl 5-nitro-2-pyrrolidin-1-yl-benzoate|2-{Methyl[(2,3,4-trimethoxyphenyl)methyl]amino}-2-oxoethyl 5-nitro-2-(pyrrolidin-1-yl)benzoate|MLS002245950|SMR001309579
| Molecular Formula | C24H29N3O8 |
|---|---|
| Molecular Weight | 487.20 g/mol |
| LogP | 3.0362 |
| Topological Polar Surface Area | 120.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 487.19547 |
| Heavy Atoms | 35 |
| Complexity | 1098.4171 |
Chemical Identifiers
| CAS Number | 852906-60-6 |
|---|---|
| SMILES | CN(CC1=C(C(=C(C=C1)OC)OC)OC)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3 |
Product Overview
[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate (CAS 852906-60-6), with molecular formula C24H29N3O8 and molecular weight 487.20 g/mol. IUPAC: [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate.
Chemical Property Profile of [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate
Property Insights of [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate
The XLogP value of 3.0362 indicates that [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.68 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate. Following Lipinski's Rule of Five, [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate has 0 hydrogen bond donor(s) and 9 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-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate?
The CAS number of [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate is 852906-60-6.
What is the molecular formula of [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate?
The molecular formula of [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate is C24H29N3O8.
What is the molecular weight of [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate?
The molecular weight of [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate is 487.20 g/mol.
Where can I buy [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate?
You can request a quote for [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl] 5-nitro-2-pyrrolidin-1-ylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.