N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine
TL;DR: N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine (CAS 445413-75-2) is a chemical compound with molecular formula C15H16N6O and molecular weight 296.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-[(3-phenylmethoxyphenyl)methyl]tetrazole-1,5-diamine
Also Known As: N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine, 1-N-[(3-phenylmethoxyphenyl)methyl]tetrazole-1,5-diamine, AN-465/40854222, N~1~-[3-(benzyloxy)benzyl]-1H-tetraazole-1,5-diamine, N1-(3-(benzyloxy)benzyl)-1H-tetrazole-1,5-diamine
| Molecular Formula | C15H16N6O |
|---|---|
| Molecular Weight | 296.14 g/mol |
| LogP | 1.578 |
| Topological Polar Surface Area | 90.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.13855 |
| Heavy Atoms | 22 |
| Complexity | 727.6623 |
Chemical Identifiers
| CAS Number | 445413-75-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=CC(=C2)CNN3C(=NN=N3)N |
Product Overview
N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine (CAS 445413-75-2), with molecular formula C15H16N6O and molecular weight 296.14 g/mol. IUPAC: 1-N-[(3-phenylmethoxyphenyl)methyl]tetrazole-1,5-diamine.
Chemical Property Profile of N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine
Property Insights of N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine
The XLogP value of 1.578 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine. The TPSA of 90.88 Ų falls within the moderate polarity range, balancing permeability and solubility for N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine. Following Lipinski's Rule of Five, N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine has 2 hydrogen bond donor(s) and 6 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 N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine?
The CAS number of N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine is 445413-75-2.
What is the molecular formula of N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine?
The molecular formula of N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine is C15H16N6O.
What is the molecular weight of N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine?
The molecular weight of N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine is 296.14 g/mol.
Where can I buy N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine?
You can request a quote for N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine?
Yes, KEHONG BIO provides custom synthesis services for N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.