TL;DR: [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid (CAS 1212382-16-5) is a chemical compound with molecular formula C19H24N2O4 and molecular weight 344.1736 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4H-1,2-oxazol-5-yl]acetic acid
Also Known As: 2-[(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4H-1,2-oxazol-5-yl]acetic Acid, (S)-2-(3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydroisoxazol-5-yl)acetic acid, [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid
| Molecular Formula | C19H24N2O4 |
| Molecular Weight | 344.1736 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 88.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.1736 Da |
| Heavy Atoms | 25 |
| Complexity | 522.0 |
| SMILES | C1CCC(CC1)NC(=O)[C@]2(CC(=NO2)CC3=CC=CC=C3)CC(=O)O |
| InChIKey | BFHSDGDCKBMORD-IBGZPJMESA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid. Following Lipinski's Rule of Five, [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid has 2 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 [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid is 1212382-16-5.
The molecular formula of [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid is C19H24N2O4.
The molecular weight of [(5S)-3-benzyl-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid is 344.1736 g/mol.
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