Reproterol
7-[3-[[2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethylpurine-2,6-dione
| Molecular Formula | C18H23N5O5 |
|---|---|
| Molecular Weight | 389.4 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 131.0 A2 |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.16992 |
| Heavy Atoms | 28 |
| Complexity | 569.0 |
Chemical Identifiers
| CAS Number | 54063-54-6 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCNCC(C3=CC(=CC(=C3)O)O)O |
| InChIKey | WVLAAKXASPCBGT-UHFFFAOYSA-N |
📖 Product Overview
Reproterol (CAS: 54063-54-6) is a chemical compound with molecular formula C18H23N5O5 and molecular weight 389.4 g/mol. Its IUPAC systematic name is 7-[3-[[2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethylpurine-2,6-dione.
WVLAAKXASPCBGT-UHFFFAOYSA-N.
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCNCC(C3=CC(=CC(=C3)O)O)O.
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