![5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole structure](/static/products/7235/7235-35-0.webp)
5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole
TL;DR: 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole (CAS 7235-35-0) is a chemical compound with molecular formula C18H21ClN4S and molecular weight 360.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-chloro-1-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethyl]sulfanyl-1-phenyltetrazole
Also Known As: 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole, 5-[2-chloro-1-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethyl]sulfanyl-1-phenyltetrazole, 5-[2-chloro-1-(6,6-dimethyl-5-bicyclo[2.2.1]heptylidene)ethyl]sulfanyl-1-phenyl-tetrazole
| Molecular Formula | C18H21ClN4S |
|---|---|
| Molecular Weight | 360.12 g/mol |
| LogP | 4.7034 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.11755 |
| Heavy Atoms | 24 |
| Complexity | 768.33575 |
Chemical Identifiers
| CAS Number | 7235-35-0 |
|---|---|
| SMILES | CC1(C2CCC(C2)C1=C(CCl)SC3=NN=NN3C4=CC=CC=C4)C |
Product Overview
5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole (CAS 7235-35-0), with molecular formula C18H21ClN4S and molecular weight 360.12 g/mol. IUPAC: 5-[2-chloro-1-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethyl]sulfanyl-1-phenyltetrazole.
Chemical Property Profile of 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole
Property Insights of 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole
The XLogP value of 4.7034 indicates that 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole 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 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole?
The CAS number of 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole is 7235-35-0.
What is the molecular formula of 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole?
The molecular formula of 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole is C18H21ClN4S.
What is the molecular weight of 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole?
The molecular weight of 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole is 360.12 g/mol.
Where can I buy 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole?
You can request a quote for 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-{[2-Chloro-1-(3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethyl]sulfanyl}-1-phenyl-1H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.