![Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate structure](/static/products/5246/524677-20-1.webp)
Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate
TL;DR: Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate (CAS 524677-20-1) is a chemical compound with molecular formula C14H18N2O6 and molecular weight 310.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(3-ethoxypropylcarbamoyl)-5-nitrobenzoate
Also Known As: methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate, methyl 3-(3-ethoxypropylcarbamoyl)-5-nitrobenzoate, methyl 3-((3-ethoxypropyl)carbamoyl)-5-nitrobenzoate, methyl 5-[N-(3-ethoxypropyl)carbamoyl]-3-nitrobenzoate, METHYL 3-{[(3-ETHOXYPROPYL)AMINO]CARBONYL}-5-NITROBENZOATE
| Molecular Formula | C14H18N2O6 |
|---|---|
| Molecular Weight | 310.12 g/mol |
| LogP | 1.5378 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 310.1165 |
| Heavy Atoms | 22 |
| Complexity | 558.2641 |
Chemical Identifiers
| CAS Number | 524677-20-1 |
|---|---|
| SMILES | CCOCCCNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC |
Product Overview
Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate (CAS 524677-20-1), with molecular formula C14H18N2O6 and molecular weight 310.12 g/mol. IUPAC: methyl 3-(3-ethoxypropylcarbamoyl)-5-nitrobenzoate.
Chemical Property Profile of Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate
Property Insights of Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate
The XLogP value of 1.5378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate. Following Lipinski's Rule of Five, Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate 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 Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate?
The CAS number of Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate is 524677-20-1.
What is the molecular formula of Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate?
The molecular formula of Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate is C14H18N2O6.
What is the molecular weight of Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate?
The molecular weight of Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate is 310.12 g/mol.
Where can I buy Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate?
You can request a quote for Methyl 3-[(3-ethoxypropyl)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-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(3-ethoxypropyl)carbamoyl]-5-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.