1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine
TL;DR: 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine (CAS 6473-98-9) is a chemical compound with molecular formula C3H7N5 and molecular weight 113.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyltetrazol-5-imine
Also Known As: 1,4-dimethyltetrazol-5-imine, 1,4-dimethyl-5-iminotetrazole, 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine, 1,4-Dimethyl-1H-tetrazol-5(4H)-imine, 1,4-Dimethyl-5(4H)-imino-1H-tetrazole
| Molecular Formula | C3H7N5 |
|---|---|
| Molecular Weight | 113.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 113.070145 |
| Heavy Atoms | 8 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 6473-98-9 |
|---|---|
| SMILES | CN1C(=N)N(N=N1)C |
| InChIKey | BBHVKOFBTGXECP-UHFFFAOYSA-N |
Product Overview
1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine (CAS 6473-98-9), with molecular formula C3H7N5 and molecular weight 113.07 g/mol. IUPAC: 1,4-dimethyltetrazol-5-imine.
Chemical Property Profile of 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine
Property Insights of 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine. With a topological polar surface area (TPSA) of 55.1 Ų, 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine has 1 hydrogen bond donor(s) and 3 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-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine?
The CAS number of 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine is 6473-98-9.
What is the molecular formula of 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine?
The molecular formula of 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine is C3H7N5.
What is the molecular weight of 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine?
The molecular weight of 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine is 113.07 g/mol.
Where can I buy 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine?
You can request a quote for 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimethyl-1,4-dihydro-5H-tetrazol-5-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.