Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide
TL;DR: Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide (CAS 470-77-9) is a chemical compound with molecular formula C29H33BrN2O4 and molecular weight 552.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-5-(4-benzylmorpholin-4-ium-4-yl)-1-(4-nitrophenyl)pentan-1-one bromide
Also Known As: 5502 HyL, HC 5502, 4-benzyl-4-[4-benzyl-5-(4-nitrophenyl)-5-oxopentyl]morpholin-4-ium bromide, 4-Benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)morpholinium bromide, Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide
| Molecular Formula | C29H33BrN2O4 |
|---|---|
| Molecular Weight | 552.16 g/mol |
| LogP | 2.47 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 552.16235 |
| Heavy Atoms | 36 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 470-77-9 |
|---|---|
| SMILES | C1COCC[N+]1(CCCC(CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4.[Br-] |
| InChIKey | UWNNXOOEDUUMQJ-UHFFFAOYSA-M |
Product Overview
Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide (CAS 470-77-9), with molecular formula C29H33BrN2O4 and molecular weight 552.16 g/mol. IUPAC: 2-benzyl-5-(4-benzylmorpholin-4-ium-4-yl)-1-(4-nitrophenyl)pentan-1-one bromide.
Chemical Property Profile of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide
Property Insights of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide
The XLogP value of 2.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide. Following Lipinski's Rule of Five, Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide?
The CAS number of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide is 470-77-9.
What is the molecular formula of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide?
The molecular formula of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide is C29H33BrN2O4.
What is the molecular weight of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide?
The molecular weight of Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide is 552.16 g/mol.
Where can I buy Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide?
You can request a quote for Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Morpholinium, 4-benzyl-4-(3-(N-benzyl-p-nitrobenzamido)propyl)-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.