5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-
TL;DR: 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- (CAS 54986-15-1) is a chemical compound with molecular formula C6H12N4 and molecular weight 140.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyl-5-propan-2-ylidenetetrazole
Also Known As: 1,4-dimethyl-5-propan-2-ylidenetetrazole, 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-, 1,4-dimethyl-5-(propan-2-ylidene)-4,5-dihydro-1H-tetrazole
| Molecular Formula | C6H12N4 |
|---|---|
| Molecular Weight | 140.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.1062 |
| Heavy Atoms | 10 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 54986-15-1 |
|---|---|
| SMILES | CC(=C1N(N=NN1C)C)C |
| InChIKey | PMKOYWPWISQOKG-UHFFFAOYSA-N |
Product Overview
5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- (CAS 54986-15-1), with molecular formula C6H12N4 and molecular weight 140.11 g/mol. IUPAC: 1,4-dimethyl-5-propan-2-ylidenetetrazole.
Chemical Property Profile of 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-
Property Insights of 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-. With a topological polar surface area (TPSA) of 31.2 Ų, 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- has 0 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 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-?
The CAS number of 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- is 54986-15-1.
What is the molecular formula of 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-?
The molecular formula of 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- is C6H12N4.
What is the molecular weight of 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-?
The molecular weight of 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- is 140.11 g/mol.
Where can I buy 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-?
You can request a quote for 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)-?
Yes, KEHONG BIO provides custom synthesis services for 5H-Tetrazole, 1,4-dihydro-1,4-dimethyl-5-(1-methylethlidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.