烯禾啶
TL;DR: 烯禾啶 (CAS 74051-80-2) 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.
烯禾啶
2-[(E)-N-ethoxy-C-propylcarbonimidoyl]-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione
Also Known As: 2-[1-(Ethoxyimino)butyl]-5-(2-ethylthiopropyl)cyclohexane-1,3-dione, 2-[1-(ethoxyimino)butyl]-5-[2-(ethylsulfanyl)propyl]cyclohexane-1,3-dione, 2-[(E)-N-ethoxy-C-propyl-carbonimidoyl]-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione, 2-[(E)-N-ethoxy-C-propylcarbonimidoyl]-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione, 2-{1-[(E)-Ethoxyimino]-butyl}-5-(2-ethylsulfanyl-propyl)-3-hydroxy-cyclohex-2-enone
| 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 | 74051-80-2 |
|---|---|
| SMILES | CCC/C(=N\OCC)/C1C(=O)CC(CC1=O)CC(C)SCC |
Product Overview
烯禾啶 (CAS 74051-80-2), with molecular formula C17H29NO3S and molecular weight 327.19 g/mol. IUPAC: 2-[(E)-N-ethoxy-C-propylcarbonimidoyl]-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione.
Chemical Property Profile of 烯禾啶
Property Insights of 烯禾啶
The XLogP value of 3.8751 indicates that 烯禾啶 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.73 Ų, 烯禾啶 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 烯禾啶 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 烯禾啶?
The CAS number of 烯禾啶 is 74051-80-2.
What is the molecular formula of 烯禾啶?
The molecular formula of 烯禾啶 is C17H29NO3S.
What is the molecular weight of 烯禾啶?
The molecular weight of 烯禾啶 is 327.19 g/mol.
Where can I buy 烯禾啶?
You can request a quote for 烯禾啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 烯禾啶?
Yes, KEHONG BIO provides custom synthesis services for 烯禾啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.