1,2-Dioxetane,3-methyl-3-phenyl
TL;DR: 1,2-Dioxetane,3-methyl-3-phenyl (CAS 353228-03-2) is a chemical compound with molecular formula C27H29N5O3 and molecular weight 471.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[[7-(1-ethanimidoylpiperidin-4-yl)oxy-3-oxo-1,4-benzoxazin-4-yl]methyl]naphthalene-2-carboximidamide
Also Known As: 1,2-Dioxetane,3-methyl-3-phenyl, J1.872.580K, 2-Naphthalenecarboximidamide, 7-[[2,3-dihydro-7-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-3-oxo-4H-1,4-benzoxazin-4-yl]methyl]-, 2-Naphthalenecarboximidamide,7-[[2,3-dihydro-7-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-3-oxo-4H-1,4-benzoxazin-4-yl]methyl]-, 7-({7-[(1-Ethanimidoyl-4-piperidinyl)oxy]-3-oxo-2,3-dihydro-4H-1, 4-benzoxazin-4-yl}methyl)-2-naphthalenecarboximidamide
| Molecular Formula | C27H29N5O3 |
|---|---|
| Molecular Weight | 471.23 g/mol |
| LogP | 3.88984 |
| Topological Polar Surface Area | 115.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.22705 |
| Heavy Atoms | 35 |
| Complexity | 1313.4147 |
Chemical Identifiers
| CAS Number | 353228-03-2 |
|---|---|
| SMILES | CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(=O)CO3)CC4=CC5=C(C=C4)C=CC(=C5)C(=N)N |
Product Overview
1,2-Dioxetane,3-methyl-3-phenyl (CAS 353228-03-2), with molecular formula C27H29N5O3 and molecular weight 471.23 g/mol. IUPAC: 7-[[7-(1-ethanimidoylpiperidin-4-yl)oxy-3-oxo-1,4-benzoxazin-4-yl]methyl]naphthalene-2-carboximidamide.
Chemical Property Profile of 1,2-Dioxetane,3-methyl-3-phenyl
Property Insights of 1,2-Dioxetane,3-methyl-3-phenyl
The XLogP value of 3.88984 indicates that 1,2-Dioxetane,3-methyl-3-phenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dioxetane,3-methyl-3-phenyl. Following Lipinski's Rule of Five, 1,2-Dioxetane,3-methyl-3-phenyl has 3 hydrogen bond donor(s) and 5 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 1,2-Dioxetane,3-methyl-3-phenyl?
The CAS number of 1,2-Dioxetane,3-methyl-3-phenyl is 353228-03-2.
What is the molecular formula of 1,2-Dioxetane,3-methyl-3-phenyl?
The molecular formula of 1,2-Dioxetane,3-methyl-3-phenyl is C27H29N5O3.
What is the molecular weight of 1,2-Dioxetane,3-methyl-3-phenyl?
The molecular weight of 1,2-Dioxetane,3-methyl-3-phenyl is 471.23 g/mol.
Where can I buy 1,2-Dioxetane,3-methyl-3-phenyl?
You can request a quote for 1,2-Dioxetane,3-methyl-3-phenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dioxetane,3-methyl-3-phenyl?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dioxetane,3-methyl-3-phenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.