TL;DR: N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine (CAS 151945-59-4) is a chemical compound with molecular formula C13H15Cl2N3 and molecular weight 283.0643 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3,4-dichlorophenyl)methyl]-3-imidazol-1-ylpropan-1-amine
Also Known As: AN-465/43422064, N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine, N-[(3,4-dichlorophenyl)methyl]-3-imidazol-1-ylpropan-1-amine, N-(3,4-dichlorobenzyl)-3-(1H-imidazol-1-yl)propan-1-amine, [(3,4-DICHLOROPHENYL)METHYL][3-(IMIDAZOL-1-YL)PROPYL]AMINE
| Molecular Formula | C13H15Cl2N3 |
| Molecular Weight | 283.0643 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.0643 Da |
| Heavy Atoms | 18 |
| Complexity | 240.0 |
| SMILES | C1=CC(=C(C=C1CNCCCN2C=CN=C2)Cl)Cl |
| InChIKey | OHYQBDWJZDFWDL-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine. With a topological polar surface area (TPSA) of 29.9 Ų, N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine is 151945-59-4.
The molecular formula of N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine is C13H15Cl2N3.
The molecular weight of N-(3,4-dichlorobenzyl)-N-[3-(1H-imidazol-1-yl)propyl]amine is 283.0643 g/mol.
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