1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-
TL;DR: 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- (CAS 63980-49-4) is a chemical compound with molecular formula C7H14N2S2 and molecular weight 190.05984 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,5S)-2,5-dimethylpiperazine-1-carbodithioic acid
Also Known As: USAF PD-10, KST-1A7147, 1-Piperazinecarbodithioic acid der., (2r,5s)-2,5-dimethylpiperazine-1-carbodithioic acid, trans-2,5-Dimethyl-1-piperazine-carbodithioic acid
Technical Specifications
| Molecular Formula | C7H14N2S2 |
| Molecular Weight | 190.05984 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 48.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.05984 Da |
| Heavy Atoms | 11 |
| Complexity | 161.0 |
| SMILES | C[C@@H]1CN[C@H](CN1C(=S)S)C |
| InChIKey | WZGAXFZTASRQJD-NTSWFWBYSA-N |
Chemical Property Profile of 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-
Property Insights of 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-. With a topological polar surface area (TPSA) of 48.4 Ų, 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- has 2 hydrogen bond donor(s) and 3 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-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-?
The CAS number of 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- is 63980-49-4.
What is the molecular formula of 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-?
The molecular formula of 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- is C7H14N2S2.
What is the molecular weight of 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-?
The molecular weight of 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- is 190.05984 g/mol.
Where can I buy 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-?
You can request a quote for 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)-?
Yes, CoreyChem provides custom synthesis services for 1-Piperazinecarbodithioic acid, 2,5-dimethyl-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.