(4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol
TL;DR: (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol (CAS 308106-34-5) is a chemical compound with molecular formula C24H29N3OS and molecular weight 407.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,6-dimethylanilino)-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-3-ene-2-thione
Also Known As: (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol, (Z)-4-((2,6-dimethylphenyl)imino)-7,7-dimethyl-1-(m-tolyl)-8-oxa-1,3-diazaspiro[4.5]decane-2-thione, 1-(2,6-dimethylanilino)-9,9-dimethyl-4-(3-methylphenyl)-8-oxa-2,4-diazaspiro[4.5]dec-1-ene-3-thione, 4-[(Z)-2,6-Dimethyl-phenylimino]-7,7-dimethyl-1-m-tolyl-8-oxa-1,3-diaza-spiro[4.5]decane-2-thione
| Molecular Formula | C24H29N3OS |
|---|---|
| Molecular Weight | 407.20 g/mol |
| LogP | 5.55516 |
| Topological Polar Surface Area | 36.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 407.20312 |
| Heavy Atoms | 29 |
| Complexity | 977.12036 |
Chemical Identifiers
| CAS Number | 308106-34-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=S)N=C(C23CCOC(C3)(C)C)NC4=C(C=CC=C4C)C |
Product Overview
(4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol (CAS 308106-34-5), with molecular formula C24H29N3OS and molecular weight 407.20 g/mol. IUPAC: 4-(2,6-dimethylanilino)-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-3-ene-2-thione.
Chemical Property Profile of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol
Property Insights of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol
The XLogP value of 5.55516 indicates that (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.86 Ų, (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol?
The CAS number of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol is 308106-34-5.
What is the molecular formula of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol?
The molecular formula of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol is C24H29N3OS.
What is the molecular weight of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol?
The molecular weight of (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol is 407.20 g/mol.
Where can I buy (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol?
You can request a quote for (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for (4Z)-4-[(2,6-dimethylphenyl)imino]-7,7-dimethyl-1-(3-methylphenyl)-8-oxa-1,3-diazaspiro[4.5]dec-2-ene-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.