![O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate structure](/static/products/5618/56181-01-2.webp)
O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate
TL;DR: O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate (CAS 56181-01-2) is a chemical compound with molecular formula C16H16N2O3S2 and molecular weight 348.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate
Also Known As: O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate, N-[(1Z)-[(BENZENESULFONYL)IMINO](PHENYL)METHYL]ETHOXYCARBOTHIOAMIDE
| Molecular Formula | C16H16N2O3S2 |
|---|---|
| Molecular Weight | 348.06 g/mol |
| LogP | 2.7331 |
| Topological Polar Surface Area | 67.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.06024 |
| Heavy Atoms | 23 |
| Complexity | 788.5898 |
Chemical Identifiers
| CAS Number | 56181-01-2 |
|---|---|
| SMILES | CCOC(=S)NC(=NS(=O)(=O)C1=CC=CC=C1)C2=CC=CC=C2 |
Product Overview
O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate (CAS 56181-01-2), with molecular formula C16H16N2O3S2 and molecular weight 348.06 g/mol. IUPAC: O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate.
Chemical Property Profile of O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate
Property Insights of O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate
The XLogP value of 2.7331 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate. The TPSA of 67.76 Ų falls within the moderate polarity range, balancing permeability and solubility for O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate. Following Lipinski's Rule of Five, O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate 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 O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate?
The CAS number of O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate is 56181-01-2.
What is the molecular formula of O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate?
The molecular formula of O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate is C16H16N2O3S2.
What is the molecular weight of O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate?
The molecular weight of O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate is 348.06 g/mol.
Where can I buy O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate?
You can request a quote for O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate?
Yes, KEHONG BIO provides custom synthesis services for O-ethyl N-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]carbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.