TL;DR: 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)- (CAS 119984-35-9) is a chemical compound with molecular formula C15H18N2O5 and molecular weight 306.12158 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-butoxy-1-(4-nitrobenzoyl)pyrrolidin-2-one
Also Known As: 5-butoxy-1-(4-nitrobenzoyl)pyrrolidin-2-one, (+-)-5-Butoxy-1-(4-nitrobenzoyl)-2-pyrrolidinone, 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)-, 5-Butoxy-1-[4-nitrobenzoyl]pyrrolidin-2-one, 2-Pyrrolidinone,5-butoxy-1-(4-nitrobenzoyl)-,(+-)
| Molecular Formula | C15H18N2O5 |
| Molecular Weight | 306.12158 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.12158 Da |
| Heavy Atoms | 22 |
| Complexity | 426.0 |
| SMILES | CCCCOC1CCC(=O)N1C(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | AOXAHNRBOUJRAB-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)-. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)-. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)- is 119984-35-9.
The molecular formula of 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)- is C15H18N2O5.
The molecular weight of 2-Pyrrolidinone, 5-butoxy-1-(4-nitrobenzoyl)-, (+-)- is 306.12158 g/mol.
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