(Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione
TL;DR: (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione (CAS 82073-72-1) is a chemical compound with molecular formula C17H29NO3S and molecular weight 327.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-N-ethoxy-C-propylcarbonimidoyl]-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione
Also Known As: (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione, 2-[(Z)-N-ethoxy-C-propylcarbonimidoyl]-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione
| Molecular Formula | C17H29NO3S |
|---|---|
| Molecular Weight | 327.19 g/mol |
| LogP | 3.8751 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 327.18683 |
| Heavy Atoms | 22 |
| Complexity | 390.70822 |
Chemical Identifiers
| CAS Number | 82073-72-1 |
|---|---|
| SMILES | CCC/C(=N/OCC)/C1C(=O)CC(CC1=O)CC(C)SCC |
Product Overview
(Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione (CAS 82073-72-1), with molecular formula C17H29NO3S and molecular weight 327.19 g/mol. IUPAC: 2-[(Z)-N-ethoxy-C-propylcarbonimidoyl]-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione.
Chemical Property Profile of (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione
Property Insights of (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione
The XLogP value of 3.8751 indicates that (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.73 Ų, (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione has 0 hydrogen bond donor(s) and 5 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-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione?
The CAS number of (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione is 82073-72-1.
What is the molecular formula of (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione?
The molecular formula of (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione is C17H29NO3S.
What is the molecular weight of (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione?
The molecular weight of (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione is 327.19 g/mol.
Where can I buy (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione?
You can request a quote for (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(1-(ethoxyimino)butyl)-5-(2-(ethylthio)propyl)cyclohexane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.