TL;DR: 4-Benzyl-5-chlorotetrazolo[1,5-a]quinoline (CAS 157027-47-9) is a chemical compound with molecular formula C16H11ClN4 and molecular weight 294.06723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-benzyl-5-chlorotetrazolo[1,5-a]quinoline
Also Known As: 4-benzyl-5-chlorotetrazolo[1,5-a]quinoline
| Molecular Formula | C16H11ClN4 |
| Molecular Weight | 294.06723 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.06723 Da |
| Heavy Atoms | 21 |
| Complexity | 360.0 |
| SMILES | C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3N4C2=NN=N4)Cl |
| InChIKey | NHKNYPBYAJBKDC-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that 4-Benzyl-5-chlorotetrazolo[1,5-a]quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 4-Benzyl-5-chlorotetrazolo[1,5-a]quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-5-chlorotetrazolo[1,5-a]quinoline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Benzyl-5-chlorotetrazolo[1,5-a]quinoline is 157027-47-9.
The molecular formula of 4-Benzyl-5-chlorotetrazolo[1,5-a]quinoline is C16H11ClN4.
The molecular weight of 4-Benzyl-5-chlorotetrazolo[1,5-a]quinoline is 294.06723 g/mol.
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