Fradafiban
2-[(3S,5S)-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetic acid
| Molecular Formula | C20H21N3O4 |
|---|---|
| Molecular Weight | 367.4 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 126.0 A2 |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.1532 |
| Heavy Atoms | 27 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 148396-36-5 |
|---|---|
| SMILES | C1C(C(=O)NC1COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N)CC(=O)O |
| InChIKey | IKZACQMAVUIGPY-HOTGVXAUSA-N |
📖 Product Overview
Fradafiban (CAS: 148396-36-5) is a chemical compound with molecular formula C20H21N3O4 and molecular weight 367.4 g/mol. Its IUPAC systematic name is 2-[(3S,5S)-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetic acid.
IKZACQMAVUIGPY-HOTGVXAUSA-N.
SMILES: C1C(C(=O)NC1COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N)CC(=O)O.
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