TL;DR: 2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile (CAS 105333-92-4) is a chemical compound with molecular formula C18H12ClN3 and molecular weight 305.07196 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-(2-chlorophenyl)-6-phenylpyridine-3-carbonitrile
Also Known As: 2-amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile, 2-amino-4-(2-chlorophenyl)-6-phenylpyridine-3-carbonitrile, 7H-315S, J1.126.328C, 2-amino-4-(2-chlorophenyl)-6-phenyl-pyridine-3-carbonitrile
| Molecular Formula | C18H12ClN3 |
| Molecular Weight | 305.07196 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.07196 Da |
| Heavy Atoms | 22 |
| Complexity | 412.0 |
| SMILES | C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3Cl)C#N)N |
| InChIKey | DOTFDSKMEYTLRC-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that 2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile. Following Lipinski's Rule of Five, 2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile has 1 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 2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile is 105333-92-4.
The molecular formula of 2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile is C18H12ClN3.
The molecular weight of 2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile is 305.07196 g/mol.
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