TL;DR: RefChem:268067 (CAS 126568-04-5) is a chemical compound with molecular formula C19H20ClN3O and molecular weight 341.1295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-1-[2-(dimethylamino)ethyl]-4-phenyl-3H-1,5-benzodiazepin-2-one
Also Known As: 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-1-(2-(dimethylamino)ethyl)-4-phenyl-, 1,3-Dihydro-7-chloro-1-(2-(dimethylamino)ethyl)-4-phenyl-2H-1,5-benzodiazepin-2-one, 7-Cloro-4-fenil-1-((dimetilammino)etil)-1,3-diidro-2H-1,5-benzodiazepin-2-one [Italian], 7-Cloro-4-fenil-1-((dimetilammino)etil)-1,3-diidro-2H-1,5-benzodiazepin-2-one, 7-chloro-1-(2-dimethylaminoethyl)-4-phenyl-3H-1,5-benzodiazepin-2-one
| Molecular Formula | C19H20ClN3O |
| Molecular Weight | 341.1295 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.1295 Da |
| Heavy Atoms | 24 |
| Complexity | 473.0 |
| SMILES | CN(C)CCN1C(=O)CC(=NC2=C1C=CC(=C2)Cl)C3=CC=CC=C3 |
| InChIKey | MNLMMTWAMHKDIZ-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that RefChem:268067 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, RefChem:268067 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268067 has 0 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:268067 is 126568-04-5.
The molecular formula of RefChem:268067 is C19H20ClN3O.
The molecular weight of RefChem:268067 is 341.1295 g/mol.
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