TL;DR: 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride (CAS 113913-50-1) is a chemical compound with molecular formula C21H27Cl2N3O2 and molecular weight 423.14804 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(4-benzhydrylpiperazin-1-yl)methyl]-1,3-oxazolidin-2-one;dihydrochloride
Also Known As: 5-((4-(Diphenylmethyl)-1-piperazinyl)methyl)-2-oxazolidinone dihydrochloride, 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride, 5-[(4-benzhydrylpiperazin-1-yl)methyl]-1,3-oxazolidin-2-one dihydrochloride, 5-{[4-(Diphenylmethyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3-oxazol-2-ol--hydrogen chloride (1/2)
| Molecular Formula | C21H27Cl2N3O2 |
| Molecular Weight | 423.14804 g/mol |
| XLogP | 3.3456 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.14804 Da |
| Heavy Atoms | 28 |
| Complexity | 434.0 |
| SMILES | C1CN(CCN1CC2CNC(=O)O2)C(C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl |
| InChIKey | HOKRRJJJAFDHON-UHFFFAOYSA-N |
The XLogP value of 3.3456 indicates that 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride has 3 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 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride is 113913-50-1.
The molecular formula of 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride is C21H27Cl2N3O2.
The molecular weight of 2-Oxazolidinone, 5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-, dihydrochloride is 423.14804 g/mol.
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