1-(Diphenylphosphino)-1H-azepine 1-oxide
TL;DR: 1-(Diphenylphosphino)-1H-azepine 1-oxide (CAS 56909-19-4) is a chemical compound with molecular formula C18H16NOP and molecular weight 293.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-oxidoazepin-1-ium-1-yl)-diphenylphosphane
Also Known As: 1- -1H-azepine1-oxide, 1-(Diphenylphosphino)-1H-azepine 1-oxide, (1-oxidoazepin-1-ium-1-yl)-diphenylphosphane, 1H-Azepine, 1-(diphenylphosphino)-, 1-oxide, 1-(diphenylphosphanyl)-1H-azepin-1-ium-1-olate
| Molecular Formula | C18H16NOP |
|---|---|
| Molecular Weight | 293.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.09695 |
| Heavy Atoms | 21 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 56909-19-4 |
|---|---|
| SMILES | C1=CC=C[N+](C=C1)([O-])P(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | BZUVYBPGEDXWBW-UHFFFAOYSA-N |
Product Overview
1-(Diphenylphosphino)-1H-azepine 1-oxide (CAS 56909-19-4), with molecular formula C18H16NOP and molecular weight 293.10 g/mol. IUPAC: (1-oxidoazepin-1-ium-1-yl)-diphenylphosphane.
Chemical Property Profile of 1-(Diphenylphosphino)-1H-azepine 1-oxide
Property Insights of 1-(Diphenylphosphino)-1H-azepine 1-oxide
The XLogP value of 4.1 indicates that 1-(Diphenylphosphino)-1H-azepine 1-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.1 Ų, 1-(Diphenylphosphino)-1H-azepine 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Diphenylphosphino)-1H-azepine 1-oxide has 0 hydrogen bond donor(s) and 1 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 1-(Diphenylphosphino)-1H-azepine 1-oxide?
The CAS number of 1-(Diphenylphosphino)-1H-azepine 1-oxide is 56909-19-4.
What is the molecular formula of 1-(Diphenylphosphino)-1H-azepine 1-oxide?
The molecular formula of 1-(Diphenylphosphino)-1H-azepine 1-oxide is C18H16NOP.
What is the molecular weight of 1-(Diphenylphosphino)-1H-azepine 1-oxide?
The molecular weight of 1-(Diphenylphosphino)-1H-azepine 1-oxide is 293.10 g/mol.
Where can I buy 1-(Diphenylphosphino)-1H-azepine 1-oxide?
You can request a quote for 1-(Diphenylphosphino)-1H-azepine 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Diphenylphosphino)-1H-azepine 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1-(Diphenylphosphino)-1H-azepine 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.