TL;DR: Aniline, 3-(1H-tetrazol-5-yl)- (CAS 73732-51-1) is a chemical compound with molecular formula C7H7N5 and molecular weight 161.07014 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2H-tetrazol-5-yl)aniline
Also Known As: 5-(3-Aminophenyl)tetrazole, 3-(1H-Tetrazol-5-yl)aniline, 3-(2H-tetrazol-5-yl)aniline, 5-(m-Aminophenyl)tetrazole, 3-aminophenyltetrazole
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H7N5 |
| Molecular Weight | 161.07014 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 80.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.07014 Da |
| Heavy Atoms | 12 |
| Complexity | 151.0 |
| SMILES | C1=CC(=CC(=C1)N)C2=NNN=N2 |
| InChIKey | FLGISLVJQPPAMV-UHFFFAOYSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aniline, 3-(1H-tetrazol-5-yl)-. The TPSA of 80.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Aniline, 3-(1H-tetrazol-5-yl)-. Following Lipinski's Rule of Five, Aniline, 3-(1H-tetrazol-5-yl)- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Aniline, 3-(1H-tetrazol-5-yl)- is 73732-51-1.
The molecular formula of Aniline, 3-(1H-tetrazol-5-yl)- is C7H7N5.
The molecular weight of Aniline, 3-(1H-tetrazol-5-yl)- is 161.07014 g/mol.
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