TL;DR: N-[(4-Diethylaminophenyl)methylideneamino]-4-nitro-aniline (CAS 101588-51-6) is a chemical compound with molecular formula C17H20N4O2 and molecular weight 312.15863 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-4-[[(4-nitrophenyl)hydrazinylidene]methyl]aniline
Also Known As: N-[(4-DIETHYLAMINOPHENYL)METHYLIDENEAMINO]-4-NITRO-ANILINE, N,N-diethyl-4-[[(4-nitrophenyl)hydrazinylidene]methyl]aniline, 4-(DIETHYLAMINO)BENZALDEHYDE (4-NITROPHENYL)HYDRAZONE, N,N-Diethyl-4-{[2-(4-nitrophenyl)hydrazinylidene]methyl}aniline
| Molecular Formula | C17H20N4O2 |
| Molecular Weight | 312.15863 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 73.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.15863 Da |
| Heavy Atoms | 23 |
| Complexity | 377.0 |
| SMILES | CCN(CC)C1=CC=C(C=C1)C=NNC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | VTKKMSURKTWECD-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that N-[(4-Diethylaminophenyl)methylideneamino]-4-nitro-aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-Diethylaminophenyl)methylideneamino]-4-nitro-aniline. Following Lipinski's Rule of Five, N-[(4-Diethylaminophenyl)methylideneamino]-4-nitro-aniline 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 N-[(4-Diethylaminophenyl)methylideneamino]-4-nitro-aniline is 101588-51-6.
The molecular formula of N-[(4-Diethylaminophenyl)methylideneamino]-4-nitro-aniline is C17H20N4O2.
The molecular weight of N-[(4-Diethylaminophenyl)methylideneamino]-4-nitro-aniline is 312.15863 g/mol.
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