TL;DR: 4-Azido-3-benzyl-2-chloro-quinoline (CAS 157027-35-5) 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-azido-3-benzyl-2-chloroquinoline
Also Known As: 4-azido-3-benzyl-2-chloro-quinoline, 4-azido-3-benzyl-2-chloroquinoline, NCI60_024098, 3-Benzyl-2-chloro-4-(2.lambda.~5~-1,2-triazadienyl)quinoline
| Molecular Formula | C16H11ClN4 |
| Molecular Weight | 294.06723 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 27.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.06723 Da |
| Heavy Atoms | 21 |
| Complexity | 390.0 |
| SMILES | C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3N=C2Cl)N=[N+]=[N-] |
| InChIKey | VYRPSBGXRZRSBM-UHFFFAOYSA-N |
The XLogP value of 6.0 indicates that 4-Azido-3-benzyl-2-chloro-quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.3 Ų, 4-Azido-3-benzyl-2-chloro-quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Azido-3-benzyl-2-chloro-quinoline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4-Azido-3-benzyl-2-chloro-quinoline is 157027-35-5.
The molecular formula of 4-Azido-3-benzyl-2-chloro-quinoline is C16H11ClN4.
The molecular weight of 4-Azido-3-benzyl-2-chloro-quinoline is 294.06723 g/mol.
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