1-(4-Chlorobenzyl)-1h-tetrazol-5-amine
TL;DR: 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine (CAS 31936-92-2) is a chemical compound with molecular formula C8H8ClN5 and molecular weight 209.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]tetrazol-5-amine
Also Known As: 1-(4-chlorobenzyl)-1h-tetrazol-5-amine, chlorobenzyltetraazolylamine, 1-(4-chlorobenzyl)-1H-1,2,3,4-tetraazol-5-ylamine, 1-[(4-chlorophenyl)methyl]tetrazol-5-amine, KST-1B3040
| Molecular Formula | C8H8ClN5 |
|---|---|
| Molecular Weight | 209.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.04683 |
| Heavy Atoms | 14 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 31936-92-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C(=NN=N2)N)Cl |
| InChIKey | CEETZLWFCRIUJU-UHFFFAOYSA-N |
Product Overview
1-(4-Chlorobenzyl)-1h-tetrazol-5-amine (CAS 31936-92-2), with molecular formula C8H8ClN5 and molecular weight 209.05 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]tetrazol-5-amine.
Chemical Property Profile of 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine
Property Insights of 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine. Following Lipinski's Rule of Five, 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine has 1 hydrogen bond donor(s) and 4 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-(4-Chlorobenzyl)-1h-tetrazol-5-amine?
The CAS number of 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine is 31936-92-2.
What is the molecular formula of 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine?
The molecular formula of 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine is C8H8ClN5.
What is the molecular weight of 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine?
The molecular weight of 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine is 209.05 g/mol.
Where can I buy 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine?
You can request a quote for 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorobenzyl)-1h-tetrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.