![1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole structure](/static/products/1388/138883-74-6.webp)
1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole
TL;DR: 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole (CAS 138883-74-6) is a chemical compound with molecular formula C18H19N3S and molecular weight 309.12997 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-phenylsulfanylcyclohexyl)benzotriazole
Also Known As: 1-(1-phenylsulfanylcyclohexyl)benzotriazole, 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole, 1-[1-(Phenylthio)cyclohexyl]-1H-benzotriazole
Technical Specifications
| Molecular Formula | C18H19N3S |
| Molecular Weight | 309.12997 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 56.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.12997 Da |
| Heavy Atoms | 22 |
| Complexity | 363.0 |
| SMILES | C1CCC(CC1)(N2C3=CC=CC=C3N=N2)SC4=CC=CC=C4 |
| InChIKey | VKJBMNNXURIZPE-UHFFFAOYSA-N |
Chemical Property Profile of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole
Property Insights of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole
The XLogP value of 5.0 indicates that 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.0 Ų, 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole?
The CAS number of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole is 138883-74-6.
What is the molecular formula of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole?
The molecular formula of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole is C18H19N3S.
What is the molecular weight of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole?
The molecular weight of 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole is 309.12997 g/mol.
Where can I buy 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole?
You can request a quote for 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole?
Yes, CoreyChem provides custom synthesis services for 1-[1-(Phenylsulfanyl)cyclohexyl]-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.