N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine
TL;DR: N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine (CAS 892605-26-4) is a chemical compound with molecular formula C12H17ClN6O2 and molecular weight 312.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-[(3-chloro-4,5-diethoxyphenyl)methyl]tetrazole-1,5-diamine
Also Known As: N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine, AN-465/42519458, 1-N-[(3-chloro-4,5-diethoxyphenyl)methyl]tetrazole-1,5-diamine, N-(5-amino-1H-tetraazol-1-yl)-N-(3-chloro-4,5-diethoxybenzyl)amine, N1-[(3-CHLORO-4,5-DIETHOXYPHENYL)METHYL]-1,2,3,4-TETRAZOLE-1,5-DIAMINE
| Molecular Formula | C12H17ClN6O2 |
|---|---|
| Molecular Weight | 312.11 g/mol |
| LogP | 1.4498 |
| Topological Polar Surface Area | 100.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 312.11014 |
| Heavy Atoms | 21 |
| Complexity | 603.4288 |
Chemical Identifiers
| CAS Number | 892605-26-4 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)CNN2C(=NN=N2)N)Cl)OCC |
Product Overview
N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine (CAS 892605-26-4), with molecular formula C12H17ClN6O2 and molecular weight 312.11 g/mol. IUPAC: 1-N-[(3-chloro-4,5-diethoxyphenyl)methyl]tetrazole-1,5-diamine.
Chemical Property Profile of N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine
Property Insights of N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine
The XLogP value of 1.4498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine. The TPSA of 100.11 Ų falls within the moderate polarity range, balancing permeability and solubility for N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine. Following Lipinski's Rule of Five, N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine has 2 hydrogen bond donor(s) and 7 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-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine?
The CAS number of N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine is 892605-26-4.
What is the molecular formula of N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine?
The molecular formula of N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine is C12H17ClN6O2.
What is the molecular weight of N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine?
The molecular weight of N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine is 312.11 g/mol.
Where can I buy N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine?
You can request a quote for N~1~-(3-chloro-4,5-diethoxybenzyl)-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-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine?
Yes, KEHONG BIO provides custom synthesis services for N~1~-(3-chloro-4,5-diethoxybenzyl)-1H-tetrazole-1,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.