TL;DR: 2,2'-Disulfanediylbis(1-phenylethan-1-amine)--hydrogen chloride (1/2) (CAS 63918-34-3) is a chemical compound with molecular formula C16H22Cl2N2S2 and molecular weight 376.06015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(2-azaniumyl-2-phenylethyl)disulfanyl]-1-phenylethyl]azanium dichloride
Also Known As: USAF XR-34, Benzylamine, alpha,alpha'-dithiodimethylenedi-, Benzylamine, alpha,alpha'-dithiobis(methylene-, Bis(2-amino-2-phenylethyl)disulfide dihydrochloride, DISULFIDE, BIS(beta-AMINOPHENETHYL)-, DIHYDROCHLORIDE
| Molecular Formula | C16H22Cl2N2S2 |
| Molecular Weight | 376.06015 g/mol |
| XLogP | -3.66 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.06015 Da |
| Heavy Atoms | 22 |
| Complexity | 225.0 |
| SMILES | C1=CC=C(C=C1)C(CSSCC(C2=CC=CC=C2)[NH3+])[NH3+].[Cl-].[Cl-] |
| InChIKey | PPCAZUMUUHGUTD-UHFFFAOYSA-N |
The XLogP value of -3.66 indicates that 2,2'-Disulfanediylbis(1-phenylethan-1-amine)--hydrogen chloride (1/2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-Disulfanediylbis(1-phenylethan-1-amine)--hydrogen chloride (1/2). Following Lipinski's Rule of Five, 2,2'-Disulfanediylbis(1-phenylethan-1-amine)--hydrogen chloride (1/2) has 2 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 2,2'-Disulfanediylbis(1-phenylethan-1-amine)--hydrogen chloride (1/2) is 63918-34-3.
The molecular formula of 2,2'-Disulfanediylbis(1-phenylethan-1-amine)--hydrogen chloride (1/2) is C16H22Cl2N2S2.
The molecular weight of 2,2'-Disulfanediylbis(1-phenylethan-1-amine)--hydrogen chloride (1/2) is 376.06015 g/mol.
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