3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol
TL;DR: 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol (CAS 328071-38-1) is a chemical compound with molecular formula C23H27N3OS and molecular weight 393.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2,6-dimethylphenyl)imino-2-methylsulfanyl-1,3-diazaspiro[4.5]dec-2-en-1-yl]phenol
Also Known As: 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol, (Z)-3-(4-((2,6-dimethylphenyl)imino)-2-(methylthio)-1,3-diazaspiro[4.5]dec-2-en-1-yl)phenol, 3-[(4Z)-4-[(2,6-dimethylphenyl)imino]-2-(methylsulfanyl)-1,3-diazaspiro[4.5]dec-2-en-1-yl]phenol
| Molecular Formula | C23H27N3OS |
|---|---|
| Molecular Weight | 393.19 g/mol |
| LogP | 5.98114 |
| Topological Polar Surface Area | 48.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 393.18747 |
| Heavy Atoms | 28 |
| Complexity | 924.36365 |
Chemical Identifiers
| CAS Number | 328071-38-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N=C2C3(CCCCC3)N(C(=N2)SC)C4=CC(=CC=C4)O |
Product Overview
3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol (CAS 328071-38-1), with molecular formula C23H27N3OS and molecular weight 393.19 g/mol. IUPAC: 3-[4-(2,6-dimethylphenyl)imino-2-methylsulfanyl-1,3-diazaspiro[4.5]dec-2-en-1-yl]phenol.
Chemical Property Profile of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol
Property Insights of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol
The XLogP value of 5.98114 indicates that 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.19 Ų, 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol?
The CAS number of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol is 328071-38-1.
What is the molecular formula of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol?
The molecular formula of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol is C23H27N3OS.
What is the molecular weight of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol?
The molecular weight of 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol is 393.19 g/mol.
Where can I buy 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol?
You can request a quote for 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-[1-(2,6-dimethylphenyl)imino-3-methylsulfanyl-2,4-diazaspiro[4.5]dec-2-en-4-yl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.