4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium
TL;DR: 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium (CAS 1035495-87-4) is a chemical compound with molecular formula C24H28ClNO2 and molecular weight 397.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-benzhydryloxybut-2-ynyl)-4-prop-2-enylmorpholin-4-ium chloride
Also Known As: 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium, 4-allyl-4-(4-(benzhydryloxy)but-2-yn-1-yl)morpholin-4-ium chloride
| Molecular Formula | C24H28ClNO2 |
|---|---|
| Molecular Weight | 397.18 g/mol |
| LogP | 0.833 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.18085 |
| Heavy Atoms | 28 |
| Complexity | 721.9422 |
Chemical Identifiers
| CAS Number | 1035495-87-4 |
|---|---|
| SMILES | C=CC[N+]1(CCOCC1)CC#CCOC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-] |
Product Overview
4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium (CAS 1035495-87-4), with molecular formula C24H28ClNO2 and molecular weight 397.18 g/mol. IUPAC: 4-(4-benzhydryloxybut-2-ynyl)-4-prop-2-enylmorpholin-4-ium chloride.
Chemical Property Profile of 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium
Property Insights of 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium
The XLogP value of 0.833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium. With a topological polar surface area (TPSA) of 18.46 Ų, 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium has 0 hydrogen bond donor(s) and 2 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-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium?
The CAS number of 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium is 1035495-87-4.
What is the molecular formula of 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium?
The molecular formula of 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium is C24H28ClNO2.
What is the molecular weight of 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium?
The molecular weight of 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium is 397.18 g/mol.
Where can I buy 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium?
You can request a quote for 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium?
Yes, KEHONG BIO provides custom synthesis services for 4-Allyl-4-(4-benzhydryloxy-but-2-ynyl)-morpholin-4-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.