TL;DR: 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide (CAS 1027746-62-8) is a chemical compound with molecular formula C23H24N5O3+ and molecular weight 418.18793 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide
Also Known As: AA-516/31407051, 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide, 4-methyl-1-(5-{4-[(4-nitrophenyl)diazenyl]anilino}-5-oxopentyl)pyridinium, Pyridinium, 4-methyl-1-[5-[[4-[2-(4-nitrophenyl)diazenyl]phenyl]amino]-5-oxopentyl]-
| Molecular Formula | C23H24N5O3+ |
| Molecular Weight | 418.18793 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.18793 Da |
| Heavy Atoms | 31 |
| Complexity | 585.0 |
| SMILES | CC1=CC=[N+](C=C1)CCCCC(=O)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | HCFIAHBYKKSPRL-UHFFFAOYSA-O |
The XLogP value of 4.4 indicates that 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide. Following Lipinski's Rule of Five, 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide is 1027746-62-8.
The molecular formula of 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide is C23H24N5O3+.
The molecular weight of 5-(4-methylpyridin-1-ium-1-yl)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]pentanamide is 418.18793 g/mol.
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