TL;DR: 2-Amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile (CAS 106043-97-4) is a chemical compound with molecular formula C19H13Cl2N3O and molecular weight 369.04358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)pyridine-3-carbonitrile
Also Known As: BAS 00692436, 2-amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile, J1.130.586E, 2-amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)pyridine-3-carbonitrile, 2-Amino-6-(3,4-dichloro-phenyl)-4-(4-methoxy-phenyl)-nicotinonitrile
| Molecular Formula | C19H13Cl2N3O |
| Molecular Weight | 369.04358 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 71.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 369.04358 Da |
| Heavy Atoms | 25 |
| Complexity | 488.0 |
| SMILES | COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=C(C=C3)Cl)Cl |
| InChIKey | YAJUNKUTBISEFV-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that 2-Amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile. Following Lipinski's Rule of Five, 2-Amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-Amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile is 106043-97-4.
The molecular formula of 2-Amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile is C19H13Cl2N3O.
The molecular weight of 2-Amino-6-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)nicotinonitrile is 369.04358 g/mol.
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