![(Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone structure](/static/products/674/674352-91-1.png)
(Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone
TL;DR: (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone (CAS 674352-91-1) is a chemical compound with molecular formula C24H27N3O2S and molecular weight 421.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[7,7-dimethyl-4-(2-methylanilino)-2-sulfanylidene-8-oxa-1,3-diazaspiro[4.5]dec-3-en-1-yl]-1-phenylethanone
Also Known As: (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone, 2-[9,9-dimethyl-1-(2-methylanilino)-3-sulfanylidene-8-oxa-2,4-diazaspiro[4.5]dec-1-en-4-yl]-1-phenylethanone, 2-{(4Z)-7,7-dimethyl-4-[(2-methylphenyl)imino]-2-sulfanyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-1-yl}-1-phenylethanone
| Molecular Formula | C24H27N3O2S |
|---|---|
| Molecular Weight | 421.18 g/mol |
| LogP | 4.61662 |
| Topological Polar Surface Area | 53.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.1824 |
| Heavy Atoms | 30 |
| Complexity | 1002.52045 |
Chemical Identifiers
| CAS Number | 674352-91-1 |
|---|---|
| SMILES | CC1=CC=CC=C1NC2=NC(=S)N(C23CCOC(C3)(C)C)CC(=O)C4=CC=CC=C4 |
Product Overview
(Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone (CAS 674352-91-1), with molecular formula C24H27N3O2S and molecular weight 421.18 g/mol. IUPAC: 2-[7,7-dimethyl-4-(2-methylanilino)-2-sulfanylidene-8-oxa-1,3-diazaspiro[4.5]dec-3-en-1-yl]-1-phenylethanone.
Chemical Property Profile of (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone
Property Insights of (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone
The XLogP value of 4.61662 indicates that (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.93 Ų, (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone has 1 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 (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone?
The CAS number of (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone is 674352-91-1.
What is the molecular formula of (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone?
The molecular formula of (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone is C24H27N3O2S.
What is the molecular weight of (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone?
The molecular weight of (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone is 421.18 g/mol.
Where can I buy (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone?
You can request a quote for (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(7,7-dimethyl-2-thioxo-4-(o-tolylimino)-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)-1-phenylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.