TL;DR: 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide (CAS 687571-46-6) is a chemical compound with molecular formula C19H20N2OS and molecular weight 324.12964 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]benzamide
Also Known As: 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide, 3-methyl-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]benzamide, F0582-0179, 3-METHYL-N-{2-[(2-METHYL-1H-INDOL-3-YL)SULFANYL]ETHYL}BENZAMIDE
| Molecular Formula | C19H20N2OS |
| Molecular Weight | 324.12964 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.12964 Da |
| Heavy Atoms | 23 |
| Complexity | 403.0 |
| SMILES | CC1=CC(=CC=C1)C(=O)NCCSC2=C(NC3=CC=CC=C32)C |
| InChIKey | ZPNBKXNNOGMCTM-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide. Following Lipinski's Rule of Five, 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is 687571-46-6.
The molecular formula of 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is C19H20N2OS.
The molecular weight of 3-methyl-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is 324.12964 g/mol.
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