TL;DR: (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide (CAS 1212118-99-4) is a chemical compound with molecular formula C18H18N6O2 and molecular weight 350.1491 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-(4-acetamidophenyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
Also Known As: (2S)-N-(4-acetamidophenyl)-3-phenyl-2-(tetrazol-1-yl)propanamide, (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide, (S)-N-(4-acetamidophenyl)-3-phenyl-2-(1H-tetrazol-1-yl)propanamide
| Molecular Formula | C18H18N6O2 |
| Molecular Weight | 350.1491 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.1491 Da |
| Heavy Atoms | 26 |
| Complexity | 474.0 |
| SMILES | CC(=O)NC1=CC=C(C=C1)NC(=O)[C@H](CC2=CC=CC=C2)N3C=NN=N3 |
| InChIKey | DDOHYWHBYOAKPJ-KRWDZBQOSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide. Following Lipinski's Rule of Five, (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide is 1212118-99-4.
The molecular formula of (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide is C18H18N6O2.
The molecular weight of (2S)-N-[4-(acetylamino)phenyl]-3-phenyl-2-(1H-tetrazol-1-yl)propanamide is 350.1491 g/mol.
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