TL;DR: N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide (CAS 1024285-11-7) is a chemical compound with molecular formula C19H25N9O4 and molecular weight 443.20294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide
Also Known As: N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide, N'-[2-methyl-3-(4-nitro-1H-pyrazol-1-yl)propanoyl]-3-(2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]decane-1-carbohydrazide, N-[2-METHYL-3-(4-NITRO-1H-PYRAZOL-1-YL)PROPANOYL]-3-(2H-1,2,3,4-TETRAAZOL-2-YL)-1-ADAMANTANECARBOHYDRAZIDE
| Molecular Formula | C19H25N9O4 |
| Molecular Weight | 443.20294 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 165.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.20294 Da |
| Heavy Atoms | 32 |
| Complexity | 775.0 |
| SMILES | CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NNC(=O)C23CC4CC(C2)CC(C4)(C3)N5N=CN=N5 |
| InChIKey | HEXQQUDKYGMLJX-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide. The TPSA of 165.0 Ų indicates high polarity, suggesting N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide is 1024285-11-7.
The molecular formula of N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide is C19H25N9O4.
The molecular weight of N'-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]-3-(tetrazol-2-yl)adamantane-1-carbohydrazide is 443.20294 g/mol.
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