C27H27N3O5 — CID 97072373
2-[(4R)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[4-(3-methylphenoxy)phenyl]acetamide (PubChem CID 97072373) has the molecular formula C27H27N3O5 and a molecular weight of 473.53 g/mol. Its IUPAC name is 2-[(4R)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[4-(3-methylphenoxy)phenyl]acetamide.
| Compound Name | 2-[(4R)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[4-(3-methylphenoxy)phenyl]acetamide |
|---|---|
| PubChem CID | 97072373 |
| Molecular Formula | C27H27N3O5 |
| Molecular Weight | 473.53 g/mol |
| Exact Mass | 473.20 |
| IUPAC Name | 2-[(4R)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[4-(3-methylphenoxy)phenyl]acetamide |
| SMILES | COc1ccccc1C[C@@]1(C)NC(=O)N(CC(=O)Nc2ccc(Oc3cccc(C)c3)cc2)C1=O |
| InChI | InChI=1S/C27H27N3O5/c1-18-7-6-9-22(15-18)35-21-13-11-20(12-14-21)28-24(31)17-30-25(32)27(2,29-26(30)33)16-19-8-4-5-10-23(19)34-3/h4-15H,16-17H2,1-3H3,(H,28,31)(H,29,33)/t27-/m1/s1 |
| InChIKey | WGBLPWIHLQAWPV-HHHXNRCGSA-N |
| XLogP | 4.29 |
| TPSA | 96.97 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 35 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 473.53 |
| LogP ≤ 5 | 4.29 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
| Structural Alerts | {'alert_name': 'hydantoin', 'substructure': 'N/A'} |
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