N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine
TL;DR: N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine (CAS 894756-70-8) is a chemical compound with molecular formula C15H21N5O2 and molecular weight 303.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-diethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine
Also Known As: N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine, AN-465/43411417, 1-allyl-N-(3,4-diethoxybenzyl)-1H-tetrazol-5-amine, N-[(3,4-diethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine, N-(3,4-diethoxybenzyl)-1-(prop-2-en-1-yl)-1H-tetrazol-5-amine
| Molecular Formula | C15H21N5O2 |
|---|---|
| Molecular Weight | 303.17 g/mol |
| LogP | 2.2686 |
| Topological Polar Surface Area | 74.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 303.16953 |
| Heavy Atoms | 22 |
| Complexity | 611.73035 |
Chemical Identifiers
| CAS Number | 894756-70-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CNC2=NN=NN2CC=C)OCC |
Product Overview
N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine (CAS 894756-70-8), with molecular formula C15H21N5O2 and molecular weight 303.17 g/mol. IUPAC: N-[(3,4-diethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine.
Chemical Property Profile of N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine
Property Insights of N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine
The XLogP value of 2.2686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine. The TPSA of 74.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine. Following Lipinski's Rule of Five, N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine has 1 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-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine?
The CAS number of N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine is 894756-70-8.
What is the molecular formula of N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine?
The molecular formula of N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine is C15H21N5O2.
What is the molecular weight of N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine?
The molecular weight of N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine is 303.17 g/mol.
Where can I buy N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine?
You can request a quote for N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-diethoxybenzyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.