TL;DR: 4-[4-(4,6-Dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol (CAS 68738-97-6) is a chemical compound with molecular formula C22H31NO and molecular weight 325.24057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[4-(4,6-dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol
Also Known As: 4(Or 5)-(di-1H-indol-1-ylmethyl)-alpha,alpha-dimethylcyclohexenebutan-1-ol, 1-Cyclohexene-1-butanol, 4(or 5)-(di-1H-indol-1-ylmethyl)-.alpha.,.alpha.-dimethyl-, 4-[4-(4,6-Dimethyl-1H-indol-1-yl)cyclohex-1-en-1-yl]-4-methylpentan-1-ol
| Molecular Formula | C22H31NO |
| Molecular Weight | 325.24057 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 25.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.24057 Da |
| Heavy Atoms | 24 |
| Complexity | 455.0 |
| SMILES | CC1=CC(=C2C=CN(C2=C1)C3CCC(=CC3)C(C)(C)CCCO)C |
| InChIKey | JVQFYQGIMPNQFN-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that 4-[4-(4,6-Dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.2 Ų, 4-[4-(4,6-Dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(4,6-Dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[4-(4,6-Dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol is 68738-97-6.
The molecular formula of 4-[4-(4,6-Dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol is C22H31NO.
The molecular weight of 4-[4-(4,6-Dimethylindol-1-yl)cyclohexen-1-yl]-4-methylpentan-1-ol is 325.24057 g/mol.
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