TL;DR: RefChem:1058001 (CAS 134221-12-8) is a chemical compound with molecular formula C13H17ClN4 and molecular weight 264.11417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(1-benzylimidazol-2-yl)methylideneamino]-N-methylmethanamine;hydrochloride
Also Known As: 1-(Phenylmethyl)-1H-imidazole-2-carboxaldehyde dimethylhydrazone monohydrochloride, 1H-Imidazole-2-carboxaldehyde, 1-(phenylmethyl)-, dimethylhydrazone, monohydrochloride, N-[(E)-(1-benzylimidazol-2-yl)methylideneamino]-N-methylmethanamine,hydrochloride
| Molecular Formula | C13H17ClN4 |
| Molecular Weight | 264.11417 g/mol |
| XLogP | 2.2487 |
| Topological Polar Surface Area (TPSA) | 33.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.11417 Da |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
| SMILES | CN(C)/N=C/C1=NC=CN1CC2=CC=CC=C2.Cl |
| InChIKey | MBGXCZZXYVWPLD-GYVLLFFHSA-N |
The XLogP value of 2.2487 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1058001. With a topological polar surface area (TPSA) of 33.4 Ų, RefChem:1058001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1058001 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:1058001 is 134221-12-8.
The molecular formula of RefChem:1058001 is C13H17ClN4.
The molecular weight of RefChem:1058001 is 264.11417 g/mol.
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