1-(1-Aziridinylcarbothioyl)aziridine
TL;DR: 1-(1-Aziridinylcarbothioyl)aziridine (CAS 13163-23-0) is a chemical compound with molecular formula C5H8N2S and molecular weight 128.04082 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(aziridin-1-yl)methanethione
Also Known As: n,n'-diethylenethiourea, 1-(1-Aziridinylcarbothioyl)aziridine, bis(aziridin-1-yl)methanethione, NCIOpen2_000567, di(aziridin-1-yl)methanethione
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H8N2S |
| Molecular Weight | 128.04082 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.04082 Da |
| Heavy Atoms | 8 |
| Complexity | 112.0 |
| SMILES | C1CN1C(=S)N2CC2 |
| InChIKey | KRZIVQTXDOLKAT-UHFFFAOYSA-N |
Chemical Property Profile of 1-(1-Aziridinylcarbothioyl)aziridine
Property Insights of 1-(1-Aziridinylcarbothioyl)aziridine
The XLogP value of -0.1 indicates that 1-(1-Aziridinylcarbothioyl)aziridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.1 Ų, 1-(1-Aziridinylcarbothioyl)aziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Aziridinylcarbothioyl)aziridine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(1-Aziridinylcarbothioyl)aziridine?
The CAS number of 1-(1-Aziridinylcarbothioyl)aziridine is 13163-23-0.
What is the molecular formula of 1-(1-Aziridinylcarbothioyl)aziridine?
The molecular formula of 1-(1-Aziridinylcarbothioyl)aziridine is C5H8N2S.
What is the molecular weight of 1-(1-Aziridinylcarbothioyl)aziridine?
The molecular weight of 1-(1-Aziridinylcarbothioyl)aziridine is 128.04082 g/mol.
Where can I buy 1-(1-Aziridinylcarbothioyl)aziridine?
You can request a quote for 1-(1-Aziridinylcarbothioyl)aziridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(1-Aziridinylcarbothioyl)aziridine?
Yes, CoreyChem provides custom synthesis services for 1-(1-Aziridinylcarbothioyl)aziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.