TL;DR: Dicyclohexyl sulfosuccinate (CAS 137361-04-7) is a chemical compound with molecular formula C16H26O7S and molecular weight 362.13992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,4-dicyclohexyloxy-1,4-dioxobutane-2-sulfonic acid
Also Known As: Dicyclohexyl sulfosuccinate, Dicyclohexyl sulfosuccinic acid, 1,4-dicyclohexyloxy-1,4-dioxobutane-2-sulfonic acid, Sulfosuccinic acid 1,4-dicyclohexyl ester, Butanedioic acid, sulfo-, 1,4-dicyclohexyl ester
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H26O7S |
| Molecular Weight | 362.13992 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.13992 Da |
| Heavy Atoms | 24 |
| Complexity | 525.0 |
| SMILES | C1CCC(CC1)OC(=O)CC(C(=O)OC2CCCCC2)S(=O)(=O)O |
| InChIKey | QPSVFNQMURAADJ-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dicyclohexyl sulfosuccinate. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dicyclohexyl sulfosuccinate. Following Lipinski's Rule of Five, Dicyclohexyl sulfosuccinate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Dicyclohexyl sulfosuccinate is 137361-04-7.
The molecular formula of Dicyclohexyl sulfosuccinate is C16H26O7S.
The molecular weight of Dicyclohexyl sulfosuccinate is 362.13992 g/mol.
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