Glycyclamide
[CAS# 664-95-9]

Identification

• Name: Glycyclamide
• Synonyms: 1-Cyclohexyl-3-(4-Methylphenyl)Sulfonyl-Urea; Benzenesulfonamide, N-[(Cyclohexylamino)Carbonyl]-4-Methyl-; K-38
• Molecular Formula: C₁₄H₂₀N₂O₃S
• Molecular Weight: 296.38
• CAS Registry Number: 664-95-9
• EINECS: 211-557-6
• SMILES: C1=CC(=CC=C1[S](NC(NC2CCCCC2)=O)(=O)=O)C
• InChI: 1S/C14H20N2O3S/c1-11-7-9-13(10-8-11)20(18,19)16-14(17)15-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H2,15,16,17)
• InChIKey: RIGBPMDIGYBTBJ-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)

References

• (1): Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493