Biotin-propranolol analog
N-[2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]ethyl]-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanamide
Also Known As: Biotin-propranolol analog|N-[2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]ethyl]-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanamide|[ inverted exclamation markA]-N-(2-Hydroxy-3-[1-naphthyloxy]propyl)-N inverted exclamation marka-biotinylethylenediamine|BPA|N-[2-({2-Hydroxy-3-[(naphthalen-1-yl)oxy]propyl}amino)ethyl]-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
| Molecular Formula | C25H34N4O4S |
|---|---|
| Molecular Weight | 486.23007 g/mol |
| LogP | 2.0111 |
| Topological Polar Surface Area | 111.72 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 486.23007 |
| Monoisotopic Mass | 486.23007 |
| Heavy Atoms | 34 |
| Complexity | 969.5861 |
Chemical Identifiers
| CAS Number | 69079-54-5 |
|---|---|
| SMILES | C1C2C(C(S1)CCCCC(=O)NCCNCC(COC3=CC=CC4=CC=CC=C43)O)NC(=O)N2 |
Product Overview
Biotin-propranolol analog (CAS 69079-54-5), with molecular formula C25H34N4O4S and molecular weight 486.23007 g/mol. IUPAC: N-[2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]ethyl]-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanamide.
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