2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate
TL;DR: 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate (CAS 63879-24-3) is a chemical compound with molecular formula C21H24N2O6 and molecular weight 400.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate
Also Known As: 2-morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate, 2-morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoa, 2-(morpholin-4-yl)ethyl 3-(benzyloxy)-4-methyl-2-nitrobenzoate
| Molecular Formula | C21H24N2O6 |
|---|---|
| Molecular Weight | 400.16 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 400.16342 |
| Heavy Atoms | 29 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 63879-24-3 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C(=O)OCCN2CCOCC2)[N+](=O)[O-])OCC3=CC=CC=C3 |
| InChIKey | AZLWYSPSJKDOCJ-UHFFFAOYSA-N |
Product Overview
2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate (CAS 63879-24-3), with molecular formula C21H24N2O6 and molecular weight 400.16 g/mol. IUPAC: 2-morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate.
Chemical Property Profile of 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate
Property Insights of 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate
The XLogP value of 3.1 indicates that 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate. Following Lipinski's Rule of Five, 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate has 0 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 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate?
The CAS number of 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate is 63879-24-3.
What is the molecular formula of 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate?
The molecular formula of 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate is C21H24N2O6.
What is the molecular weight of 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate?
The molecular weight of 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate is 400.16 g/mol.
Where can I buy 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate?
You can request a quote for 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Morpholin-4-ylethyl 4-methyl-2-nitro-3-phenylmethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.