TL;DR: Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl- (CAS 125037-78-7) is a chemical compound with molecular formula C11H12ClN5 and molecular weight 249.07812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-(4-chlorophenyl)tetrazol-5-yl]-N,N-dimethylethenamine
Also Known As: Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl-, 2-[1-(4-chlorophenyl)tetrazol-5-yl]-N,N-dimethylethenamine, Ethenamine,2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl, 2-[1-(4-Chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethylethen-1-amine
| Molecular Formula | C11H12ClN5 |
| Molecular Weight | 249.07812 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 46.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.07812 Da |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
| SMILES | CN(C)C=CC1=NN=NN1C2=CC=C(C=C2)Cl |
| InChIKey | JEZPNFLAXIIAMB-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl-. With a topological polar surface area (TPSA) of 46.8 Ų, Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl- is 125037-78-7.
The molecular formula of Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl- is C11H12ClN5.
The molecular weight of Ethenamine, 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethyl- is 249.07812 g/mol.
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