2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-
TL;DR: 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)- (CAS 112523-44-1) is a chemical compound with molecular formula C9H13NS2 and molecular weight 199.04893 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-tert-butylthiophene-2-carbothioamide
Also Known As: N-tert-butylthiophene-2-carbothioamide, 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-, N-tert-butyl-2-thiophenecarbothiamide, N-tert-Butyl-2-thiophenecarbothioamide
Technical Specifications
| Molecular Formula | C9H13NS2 |
| Molecular Weight | 199.04893 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 72.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.04893 Da |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
| SMILES | CC(C)(C)NC(=S)C1=CC=CS1 |
| InChIKey | GWQXXJRDSPKGTH-UHFFFAOYSA-N |
Chemical Property Profile of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-
Property Insights of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-. Following Lipinski's Rule of Five, 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-?
The CAS number of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)- is 112523-44-1.
What is the molecular formula of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-?
The molecular formula of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)- is C9H13NS2.
What is the molecular weight of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-?
The molecular weight of 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)- is 199.04893 g/mol.
Where can I buy 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-?
You can request a quote for 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)-?
Yes, CoreyChem provides custom synthesis services for 2-Thiophenecarbothioamide, N-(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.