TL;DR: 1H-Indole-3-carbonitrile, 5-azido-1-methyl- (CAS 121138-64-5) is a chemical compound with molecular formula C10H7N5 and molecular weight 197.07014 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-azido-1-methylindole-3-carbonitrile
Also Known As: 5-azido-1-methyl-1h-indole-3-carbonitrile, 5-Azido-3-cyano-1-methylindole, 1H-Indole-3-carbonitrile, 5-azido-1-methyl-, 5-azido-1-methylindole-3-carbonitrile, 5-azido-1-methyl-indole-3-carbonitrile
| Molecular Formula | C10H7N5 |
| Molecular Weight | 197.07014 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.07014 Da |
| Heavy Atoms | 15 |
| Complexity | 337.0 |
| SMILES | CN1C=C(C2=C1C=CC(=C2)N=[N+]=[N-])C#N |
| InChIKey | HQPAVWQLCDHGDB-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-3-carbonitrile, 5-azido-1-methyl-. With a topological polar surface area (TPSA) of 43.1 Ų, 1H-Indole-3-carbonitrile, 5-azido-1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-3-carbonitrile, 5-azido-1-methyl- has 0 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 1H-Indole-3-carbonitrile, 5-azido-1-methyl- is 121138-64-5.
The molecular formula of 1H-Indole-3-carbonitrile, 5-azido-1-methyl- is C10H7N5.
The molecular weight of 1H-Indole-3-carbonitrile, 5-azido-1-methyl- is 197.07014 g/mol.
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