TL;DR: 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole (CAS 109793-86-4) is a chemical compound with molecular formula C16H19N3O2 and molecular weight 285.14774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-nitro-3-(1-propyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole
Also Known As: 5-nitro-3-(1-propyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole, 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole, 5-Nitro-3-(1-propyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
| Molecular Formula | C16H19N3O2 |
| Molecular Weight | 285.14774 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 64.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.14774 Da |
| Heavy Atoms | 21 |
| Complexity | 418.0 |
| SMILES | CCCN1CCC(=CC1)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-] |
| InChIKey | IECZTFVRSQPBKV-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole. Following Lipinski's Rule of Five, 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole 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 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole is 109793-86-4.
The molecular formula of 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole is C16H19N3O2.
The molecular weight of 5-Nitro-3-(1,2,3,6-tetrahydro-1-propyl-4-pyridinyl)-1H-indole is 285.14774 g/mol.
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