TL;DR: 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide (CAS 689265-17-6) is a chemical compound with molecular formula C18H16F2N2O and molecular weight 314.12308 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-difluoro-N-[2-(2-methylindol-1-yl)ethyl]benzamide
Also Known As: 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide, 3,4-difluoro-N-[2-(2-methylindol-1-yl)ethyl]benzamide, 3,4-difluoro-N-(2-(2-methyl-1H-indol-1-yl)ethyl)benzamide, F0613-0187
| Molecular Formula | C18H16F2N2O |
| Molecular Weight | 314.12308 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.12308 Da |
| Heavy Atoms | 23 |
| Complexity | 420.0 |
| SMILES | CC1=CC2=CC=CC=C2N1CCNC(=O)C3=CC(=C(C=C3)F)F |
| InChIKey | JUNLFOFCRPINIR-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.0 Ų, 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide 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 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide is 689265-17-6.
The molecular formula of 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide is C18H16F2N2O.
The molecular weight of 3,4-difluoro-N-[2-(2-methyl-1H-indol-1-yl)ethyl]benzamide is 314.12308 g/mol.
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