4,4'-((3-nitrophenyl)Methylene)diMorpholine
TL;DR: 4,4'-((3-nitrophenyl)Methylene)diMorpholine (CAS 40891-03-0) is a chemical compound with molecular formula C15H21N3O4 and molecular weight 307.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[morpholin-4-yl-(3-nitrophenyl)methyl]morpholine
Also Known As: 4,4'-((3-nitrophenyl)Methylene)diMorpholine, 3-(Dimorpholinomethyl)-1-nitrobenzene, BAS 00380999, 4,4 -(3-Nitrobenzylidene)bismorpholine, 4-[morpholin-4-yl-(3-nitrophenyl)methyl]morpholine
| Molecular Formula | C15H21N3O4 |
|---|---|
| Molecular Weight | 307.15 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.1532 |
| Heavy Atoms | 22 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 40891-03-0 |
|---|---|
| SMILES | C1COCCN1C(C2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3 |
| InChIKey | OKDOZIOORNWBOI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-((3-nitrophenyl)Methylene)diMorpholine (CAS 40891-03-0), with molecular formula C15H21N3O4 and molecular weight 307.15 g/mol. IUPAC: 4-[morpholin-4-yl-(3-nitrophenyl)methyl]morpholine.
Chemical Property Profile of 4,4'-((3-nitrophenyl)Methylene)diMorpholine
Property Insights of 4,4'-((3-nitrophenyl)Methylene)diMorpholine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-((3-nitrophenyl)Methylene)diMorpholine. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-((3-nitrophenyl)Methylene)diMorpholine. Following Lipinski's Rule of Five, 4,4'-((3-nitrophenyl)Methylene)diMorpholine has 0 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 4,4'-((3-nitrophenyl)Methylene)diMorpholine?
The CAS number of 4,4'-((3-nitrophenyl)Methylene)diMorpholine is 40891-03-0.
What is the molecular formula of 4,4'-((3-nitrophenyl)Methylene)diMorpholine?
The molecular formula of 4,4'-((3-nitrophenyl)Methylene)diMorpholine is C15H21N3O4.
What is the molecular weight of 4,4'-((3-nitrophenyl)Methylene)diMorpholine?
The molecular weight of 4,4'-((3-nitrophenyl)Methylene)diMorpholine is 307.15 g/mol.
Where can I buy 4,4'-((3-nitrophenyl)Methylene)diMorpholine?
You can request a quote for 4,4'-((3-nitrophenyl)Methylene)diMorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-((3-nitrophenyl)Methylene)diMorpholine?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-((3-nitrophenyl)Methylene)diMorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.