TL;DR: (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide (CAS 1351388-95-8) is a chemical compound with molecular formula C16H13N5O and molecular weight 291.112 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-phenyl-N-[3-(tetrazol-1-yl)phenyl]prop-2-enamide
Also Known As: N-(3-(1H-tetrazol-1-yl)phenyl)cinnamamide, (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide, (E)-3-phenyl-N-[3-(tetrazol-1-yl)phenyl]prop-2-enamide
| Molecular Formula | C16H13N5O |
| Molecular Weight | 291.112 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.112 Da |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)NC2=CC(=CC=C2)N3C=NN=N3 |
| InChIKey | FWNYQEDJCMTVHS-MDZDMXLPSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide. Following Lipinski's Rule of Five, (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide has 1 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 (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide is 1351388-95-8.
The molecular formula of (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide is C16H13N5O.
The molecular weight of (2E)-3-phenyl-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide is 291.112 g/mol.
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