TL;DR: 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl- (CAS 82608-09-1) is a chemical compound with molecular formula C22H25N3O4 and molecular weight 395.1845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoyl]-3-methyl-1,3-benzoxazol-2-one
Also Known As: 6-(2-(4-(2-Methoxyphenyl)-1-piperazinyl)propionyl)-3-methylbenzoxazolinone, 6-(2-(4-(o-Methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl-2-benzoxazolinone, 2-BENZOXAZOLINONE, 6-(2-(4-(o-METHOXYPHENYL)-1-PIPERAZINYL)PROPIONYL)-3-METHYL-, 6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoyl]-3-methyl-1,3-benzoxazol-2-one, 6-[2-[4-(2-Methoxyphenyl)piperazin-1-yl]propionyl]-3-methylbenzoxazol-2(3H)-one
| Molecular Formula | C22H25N3O4 |
| Molecular Weight | 395.1845 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 62.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.1845 Da |
| Heavy Atoms | 29 |
| Complexity | 607.0 |
| SMILES | CC(C(=O)C1=CC2=C(C=C1)N(C(=O)O2)C)N3CCN(CC3)C4=CC=CC=C4OC |
| InChIKey | SCBSKCDYMPWFHI-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl-. Following Lipinski's Rule of Five, 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl- is 82608-09-1.
The molecular formula of 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl- is C22H25N3O4.
The molecular weight of 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl- is 395.1845 g/mol.
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