TL;DR: RefChem:505149 (CAS 56842-61-6) is a chemical compound with molecular formula C20H23N7O2 and molecular weight 393.1913 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(2-cyanophenyl)diazenyl]-2,6-bis(2-methoxyethylamino)-4-methylpyridine-3-carbonitrile
Also Known As: ISONONYL 3-MERCAPTOPROPIONATE, 3-Pyridinecarbonitrile, 5-[(2-cyanophenyl)azo]-2,6-bis[(2-methoxyethyl)amino]-4-methyl-, 5-[ azo]-2,6-bis[ amino]-4-methylnicotinonitrile, 5-[(2-cyanophenyl)azo]-2,6-bis[(2-methoxyethyl)amino]-4-methylnicotinonitrile, 3-Pyridinecarbonitrile, 5-((2-cyanophenyl)azo)-2,6-bis((2-methoxyethyl)amino)-4-methyl-
| Molecular Formula | C20H23N7O2 |
| Molecular Weight | 393.1913 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 393.1913 Da |
| Heavy Atoms | 29 |
| Complexity | 610.0 |
| SMILES | CC1=C(C(=NC(=C1N=NC2=CC=CC=C2C#N)NCCOC)NCCOC)C#N |
| InChIKey | SEQWUAQJBYUKJI-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that RefChem:505149 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:505149. Following Lipinski's Rule of Five, RefChem:505149 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:505149 is 56842-61-6.
The molecular formula of RefChem:505149 is C20H23N7O2.
The molecular weight of RefChem:505149 is 393.1913 g/mol.
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