![2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] structure](/static/products/839/839699-55-7.png)
2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
TL;DR: 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] (CAS 839699-55-7) is a chemical compound with molecular formula C29H26N4O and molecular weight 446.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(naphthalen-1-yloxymethyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2,4,6,11,13,16-heptaene-9,1'-cyclohexane]
Also Known As: 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane], 2-[(naphthalen-1-yloxy)methyl]-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
| Molecular Formula | C29H26N4O |
|---|---|
| Molecular Weight | 446.21 g/mol |
| LogP | 6.2815 |
| Topological Polar Surface Area | 52.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 446.21066 |
| Heavy Atoms | 34 |
| Complexity | 1525.0521 |
Chemical Identifiers
| CAS Number | 839699-55-7 |
|---|---|
| SMILES | C1CCC2(CC1)CC3=CC=CC=C3C4=C2C5=NC(=NN5C=N4)COC6=CC=CC7=CC=CC=C76 |
Product Overview
2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] (CAS 839699-55-7), with molecular formula C29H26N4O and molecular weight 446.21 g/mol. IUPAC: 13-(naphthalen-1-yloxymethyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2,4,6,11,13,16-heptaene-9,1'-cyclohexane].
Chemical Property Profile of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
Property Insights of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
The XLogP value of 6.2815 indicates that 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.31 Ų, 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]?
The CAS number of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] is 839699-55-7.
What is the molecular formula of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]?
The molecular formula of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] is C29H26N4O.
What is the molecular weight of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]?
The molecular weight of 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] is 446.21 g/mol.
Where can I buy 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]?
You can request a quote for 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]?
Yes, KEHONG BIO provides custom synthesis services for 2-((naphthalen-1-yloxy)methyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.