TL;DR: (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione (CAS 371118-58-0) is a chemical compound with molecular formula C23H27N3O3 and molecular weight 393.20523 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione, (5Z)-1-cyclohexyl-5-{[1-(2-methylpropyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-3-cyclohexyl-6-hydroxy-5-{[1-(2-methylpropyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4(3H,5H)-dione, (Z)-1-cyclohexyl-5-((1-isobutyl-1H-indol-3-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C23H27N3O3 |
| Molecular Weight | 393.20523 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.20523 Da |
| Heavy Atoms | 29 |
| Complexity | 695.0 |
| SMILES | CC(C)CN1C=C(C2=CC=CC=C21)/C=C\3/C(=O)NC(=O)N(C3=O)C4CCCCC4 |
| InChIKey | IEYLKIHMKIKNLQ-UNOMPAQXSA-N |
The XLogP value of 4.3 indicates that (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is 371118-58-0.
The molecular formula of (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is C23H27N3O3.
The molecular weight of (5Z)-1-cyclohexyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is 393.20523 g/mol.
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