![Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate structure](/static/products/3486/348605-54-9.webp)
Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate
TL;DR: Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate (CAS 348605-54-9) is a chemical compound with molecular formula C15H19N3O6 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(2-morpholin-4-ylethylcarbamoyl)-5-nitrobenzoate
Also Known As: BAS 00856728, methyl 3-((2-morpholinoethyl)carbamoyl)-5-nitrobenzoate, methyl 3-(2-morpholin-4-ylethylcarbamoyl)-5-nitrobenzoate, methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate, methyl 5-[N-(2-morpholin-4-ylethyl)carbamoyl]-3-nitrobenzoate
| Molecular Formula | C15H19N3O6 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.12738 |
| Heavy Atoms | 24 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 348605-54-9 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)C(=O)NCCN2CCOCC2)[N+](=O)[O-] |
| InChIKey | BEFLEIZRMUTULO-UHFFFAOYSA-N |
Product Overview
Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate (CAS 348605-54-9), with molecular formula C15H19N3O6 and molecular weight 337.13 g/mol. IUPAC: methyl 3-(2-morpholin-4-ylethylcarbamoyl)-5-nitrobenzoate.
Chemical Property Profile of Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate
Property Insights of Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate. Following Lipinski's Rule of Five, Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate has 1 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 Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate?
The CAS number of Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate is 348605-54-9.
What is the molecular formula of Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate?
The molecular formula of Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate is C15H19N3O6.
What is the molecular weight of Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate?
The molecular weight of Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate is 337.13 g/mol.
Where can I buy Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate?
You can request a quote for Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-{[2-(morpholin-4-yl)ethyl]carbamoyl}-5-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.