TL;DR: Benzoic acid, o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)-, methyl ester (CAS 39630-20-1) is a chemical compound with molecular formula C17H20N2O5 and molecular weight 332.1372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[4-(morpholine-4-carbonyl)-2-oxopyrrolidin-1-yl]benzoate
Also Known As: Methyl o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)benzoate, methyl 2-[4-(morpholine-4-carbonyl)-2-oxopyrrolidin-1-yl]benzoate, BENZOIC ACID, o-(4-MORPHOLINOCARBONYL-2-OXO-1-PYRROLIDINYL)-, METHYL ESTER, 2-[4-(morpholinocarbonyl)-2-oxopyrrolidin-1-yl]benzoic acid methyl ester, 2-[4-(morpholine-4-carbonyl)-2-oxo-pyrrolidin-1-yl]-benzoic acid methyl ester
| Molecular Formula | C17H20N2O5 |
| Molecular Weight | 332.1372 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 76.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.1372 Da |
| Heavy Atoms | 24 |
| Complexity | 503.0 |
| SMILES | COC(=O)C1=CC=CC=C1N2CC(CC2=O)C(=O)N3CCOCC3 |
| InChIKey | IUXOHNXARPHURE-UHFFFAOYSA-N |
The XLogP value of -0.1 indicates that Benzoic acid, o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)-, methyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)-, methyl ester. Following Lipinski's Rule of Five, Benzoic acid, o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)-, methyl ester 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 Benzoic acid, o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)-, methyl ester is 39630-20-1.
The molecular formula of Benzoic acid, o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)-, methyl ester is C17H20N2O5.
The molecular weight of Benzoic acid, o-(4-morpholinocarbonyl-2-oxo-1-pyrrolidinyl)-, methyl ester is 332.1372 g/mol.
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