肟吸威
TL;DR: 肟吸威 (CAS 39196-18-4) is a chemical compound with molecular formula C9H18N2O2S and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
肟吸威
[(3,3-dimethyl-1-methylsulfanylbutan-2-ylidene)amino] N-methylcarbamate
Also Known As: THIOFANOX, Thiofanocarb, Dacamox, Thiophanox, Benelux
| Molecular Formula | C9H18N2O2S |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 218.1089 |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
| Melting Point | 133.7 to 57.5 °C |
| Solubility | 5.2 G/L WATER AT 22 °C |
| Vapor Pressure | 0.00017 mmHg at 25.0 °C |
Chemical Identifiers
| CAS Number | 39196-18-4 |
|---|---|
| SMILES | CC(C)(C)C(=NOC(=O)NC)CSC |
| InChIKey | FZSVSABTBYGOQH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
肟吸威 (CAS 39196-18-4), with molecular formula C9H18N2O2S and molecular weight 218.11 g/mol. IUPAC: [(3,3-dimethyl-1-methylsulfanylbutan-2-ylidene)amino] N-methylcarbamate.
Chemical Property Profile of 肟吸威
Property Insights of 肟吸威
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 肟吸威. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 肟吸威. Following Lipinski's Rule of Five, 肟吸威 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 肟吸威?
The CAS number of 肟吸威 is 39196-18-4.
What is the molecular formula of 肟吸威?
The molecular formula of 肟吸威 is C9H18N2O2S.
What is the molecular weight of 肟吸威?
The molecular weight of 肟吸威 is 218.11 g/mol.
Where can I buy 肟吸威?
You can request a quote for 肟吸威 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 肟吸威?
Yes, KEHONG BIO provides custom synthesis services for 肟吸威 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.