C21H25N6O10U- — CID 145224385
(2,5-dioxopyrrolidin-4-id-1-yl) 3-[[2-[[2-[[2-[4-(2,5-dioxopyrrol-1-yl)butanoylamino]acetyl]amino]acetyl]amino]acetyl]amino]propanoate;uranium (PubChem CID 145224385) has the molecular formula C21H25N6O10U- and a molecular weight of 759.49 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-4-id-1-yl) 3-[[2-[[2-[[2-[4-(2,5-dioxopyrrol-1-yl)butanoylamino]acetyl]amino]acetyl]amino]acetyl]amino]propanoate;uranium.
| Compound Name | (2,5-dioxopyrrolidin-4-id-1-yl) 3-[[2-[[2-[[2-[4-(2,5-dioxopyrrol-1-yl)butanoylamino]acetyl]amino]acetyl]amino]acetyl]amino]propanoate;uranium |
|---|---|
| PubChem CID | 145224385 |
| Molecular Formula | C21H25N6O10U- |
| Molecular Weight | 759.49 g/mol |
| Exact Mass | 759.21 |
| IUPAC Name | (2,5-dioxopyrrolidin-4-id-1-yl) 3-[[2-[[2-[[2-[4-(2,5-dioxopyrrol-1-yl)butanoylamino]acetyl]amino]acetyl]amino]acetyl]amino]propanoate;uranium |
| SMILES | O=C(CCCN1C(=O)C=CC1=O)NCC(=O)NCC(=O)NCC(=O)NCCC(=O)ON1C(=O)[CH-]CC1=O.[U] |
| InChI | InChI=1S/C21H25N6O10.U/c28-13(2-1-9-26-17(32)3-4-18(26)33)23-11-15(30)25-12-16(31)24-10-14(29)22-8-7-21(36)37-27-19(34)5-6-20(27)35;/h3-5H,1-2,6-12H2,(H,22,29)(H,23,28)(H,24,31)(H,25,30);/q-1; |
| InChIKey | NTCUHDUSQJTKAZ-UHFFFAOYSA-N |
| XLogP | -4.03 |
| TPSA | 217.46 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 38 |
| Complexity | — |
1 violation
| Rule | Value |
|---|---|
| MW ≤ 500 | 759.49 |
| LogP ≤ 5 | -4.03 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 10 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'} |
|---|