TL;DR: 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine (CAS 606114-25-4) is a chemical compound with molecular formula C18H28N8 and molecular weight 356.24368 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[1-(1-cyclohexyltetrazol-5-yl)propyl]piperazin-1-yl]pyrimidine
Also Known As: 2-[4-[1-(1-cyclohexyltetrazol-5-yl)propyl]piperazin-1-yl]pyrimidine, 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine, Pyrimidine, 2-[4-[1-(1-cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl]- (9CI)
| Molecular Formula | C18H28N8 |
| Molecular Weight | 356.24368 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.24368 Da |
| Heavy Atoms | 26 |
| Complexity | 415.0 |
| SMILES | CCC(C1=NN=NN1C2CCCCC2)N3CCN(CC3)C4=NC=CC=N4 |
| InChIKey | VWFDJFVCCVKCJT-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine. Following Lipinski's Rule of Five, 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine is 606114-25-4.
The molecular formula of 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine is C18H28N8.
The molecular weight of 2-{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)propyl]-1-piperazinyl}pyrimidine is 356.24368 g/mol.
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