N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine
TL;DR: N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine (CAS 878424-48-7) is a chemical compound with molecular formula C13H17N5O2 and molecular weight 275.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine
Also Known As: BAS 13155474, N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine, AN-465/43369586, N-(1-allyl-1H-tetraazol-5-yl)-N-(3,4-dimethoxybenzyl)amine, 1-allyl-N-(3,4-dimethoxybenzyl)-1H-tetrazol-5-amine
| Molecular Formula | C13H17N5O2 |
|---|---|
| Molecular Weight | 275.14 g/mol |
| LogP | 1.4884 |
| Topological Polar Surface Area | 74.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 275.1382 |
| Heavy Atoms | 20 |
| Complexity | 581.89056 |
Chemical Identifiers
| CAS Number | 878424-48-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNC2=NN=NN2CC=C)OC |
Product Overview
N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine (CAS 878424-48-7), with molecular formula C13H17N5O2 and molecular weight 275.14 g/mol. IUPAC: N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine.
Chemical Property Profile of N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine
Property Insights of N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine
The XLogP value of 1.4884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine. The TPSA of 74.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine. Following Lipinski's Rule of Five, N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-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-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine?
The CAS number of N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine is 878424-48-7.
What is the molecular formula of N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine?
The molecular formula of N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine is C13H17N5O2.
What is the molecular weight of N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine?
The molecular weight of N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine is 275.14 g/mol.
Where can I buy N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine?
You can request a quote for N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,4-dimethoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.