TL;DR: Acetamidine, 2,2'-dithiobis(N-cyclohepthylmethyl-, dihydrochloride (CAS 40493-24-1) is a chemical compound with molecular formula C20H40Cl2N4S2 and molecular weight 470.20715 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-amino-2-[[2-amino-2-(cycloheptylmethylazaniumylidene)ethyl]disulfanyl]ethylidene]-(cycloheptylmethyl)azanium dichloride
Also Known As: 2,2'-Dithiobis(N-cycloheptylmethylacetamidine) dihydrochloride, ACETAMIDINE, 2,2'-DITHIOBIS(N-CYCLOHEPTHYLMETHYL-, DIHYDROCHLORIDE, Ethanimidamide, 2,2'-dithiobis[N-(cycloheptylmethyl)-, dihydrochloride, [1-amino-2-[[2-amino-2-(cycloheptylmethylazaniumylidene)ethyl]disulfanyl]ethylidene]-(cycloheptylmethyl)azanium dichloride
| Molecular Formula | C20H40Cl2N4S2 |
| Molecular Weight | 470.20715 g/mol |
| XLogP | -4.81 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.20715 Da |
| Heavy Atoms | 28 |
| Complexity | 384.0 |
| SMILES | C1CCCC(CC1)C[NH+]=C(CSSCC(=[NH+]CC2CCCCCC2)N)N.[Cl-].[Cl-] |
| InChIKey | RDGYMXDULMDNJN-UHFFFAOYSA-N |
The XLogP value of -4.81 indicates that Acetamidine, 2,2'-dithiobis(N-cyclohepthylmethyl-, dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamidine, 2,2'-dithiobis(N-cyclohepthylmethyl-, dihydrochloride. Following Lipinski's Rule of Five, Acetamidine, 2,2'-dithiobis(N-cyclohepthylmethyl-, dihydrochloride has 4 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 Acetamidine, 2,2'-dithiobis(N-cyclohepthylmethyl-, dihydrochloride is 40493-24-1.
The molecular formula of Acetamidine, 2,2'-dithiobis(N-cyclohepthylmethyl-, dihydrochloride is C20H40Cl2N4S2.
The molecular weight of Acetamidine, 2,2'-dithiobis(N-cyclohepthylmethyl-, dihydrochloride is 470.20715 g/mol.
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