TL;DR: 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid (CAS 1212318-69-8) is a chemical compound with molecular formula C20H26N2O6 and molecular weight 390.17908 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid
Also Known As: 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid, 2-[5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic Acid, (S)-2-(5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4,5-dihydroisoxazol-5-yl)acetic acid, [(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid
| Molecular Formula | C20H26N2O6 |
| Molecular Weight | 390.17908 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.17908 Da |
| Heavy Atoms | 28 |
| Complexity | 604.0 |
| SMILES | COC1=CC(=C(C=C1)OC)C2=NO[C@@](C2)(CC(=O)O)C(=O)NC3CCCCC3 |
| InChIKey | SGEWWQWRPJYOEU-FQEVSTJZSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid. Following Lipinski's Rule of Five, 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid is 1212318-69-8.
The molecular formula of 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid is C20H26N2O6.
The molecular weight of 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid is 390.17908 g/mol.
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