TL;DR: 1-(Di-2-thienylmethyl)piperazine (CAS 104523-10-6) is a chemical compound with molecular formula C13H16N2S2 and molecular weight 264.0755 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(dithiophen-2-ylmethyl)piperazine
Also Known As: 1-(Di-2-thienylmethyl)piperazine, 1-(dithiophen-2-ylmethyl)piperazine, 1-[Di(thiophen-2-yl)methyl]piperazine
| Molecular Formula | C13H16N2S2 |
| Molecular Weight | 264.0755 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.0755 Da |
| Heavy Atoms | 17 |
| Complexity | 228.0 |
| SMILES | C1CN(CCN1)C(C2=CC=CS2)C3=CC=CS3 |
| InChIKey | FESVNZIUJNPUDX-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Di-2-thienylmethyl)piperazine. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Di-2-thienylmethyl)piperazine. Following Lipinski's Rule of Five, 1-(Di-2-thienylmethyl)piperazine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(Di-2-thienylmethyl)piperazine is 104523-10-6.
The molecular formula of 1-(Di-2-thienylmethyl)piperazine is C13H16N2S2.
The molecular weight of 1-(Di-2-thienylmethyl)piperazine is 264.0755 g/mol.
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