![(1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # structure](/static/products/493/493030-63-0.png)
(1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #
TL;DR: (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # (CAS 493030-63-0) is a chemical compound with molecular formula C13H12F3N3S and molecular weight 299.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(Z)-1-benzylsulfanyl-2-cyano-3,3,3-trifluoroprop-1-enyl]ethanimidamide
Also Known As: (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #, N'-[(Z)-1-benzylsulfanyl-2-cyano-3,3,3-trifluoroprop-1-enyl]ethanimidamide, N-(1-Amino-ethylidene)-2-cyano-3,3,3-trifluoro-propenimidothioic acid benzyl ester
| Molecular Formula | C13H12F3N3S |
|---|---|
| Molecular Weight | 299.07 g/mol |
| LogP | 3.59438 |
| Topological Polar Surface Area | 62.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.0704 |
| Heavy Atoms | 20 |
| Complexity | 552.46436 |
Chemical Identifiers
| CAS Number | 493030-63-0 |
|---|---|
| SMILES | C/C(=N/C(=C(\C#N)/C(F)(F)F)/SCC1=CC=CC=C1)/N |
Product Overview
(1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # (CAS 493030-63-0), with molecular formula C13H12F3N3S and molecular weight 299.07 g/mol. IUPAC: N'-[(Z)-1-benzylsulfanyl-2-cyano-3,3,3-trifluoroprop-1-enyl]ethanimidamide.
Chemical Property Profile of (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #
Property Insights of (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #
The XLogP value of 3.59438 indicates that (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.17 Ų falls within the moderate polarity range, balancing permeability and solubility for (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #. Following Lipinski's Rule of Five, (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # has 1 hydrogen bond donor(s) and 3 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 (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #?
The CAS number of (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # is 493030-63-0.
What is the molecular formula of (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #?
The molecular formula of (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # is C13H12F3N3S.
What is the molecular weight of (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #?
The molecular weight of (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # is 299.07 g/mol.
Where can I buy (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #?
You can request a quote for (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide #?
Yes, KEHONG BIO provides custom synthesis services for (1Z)-N'-[(Z,1Z)-1-(Benzylsulfanyl)-2-cyano-3,3,3-trifluoro-1-propenyl]ethanimidamide # and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.