AC1N2XD6
propyl 2-[[2-(1-adamantyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AK-968/41021618|propyl 2-[(1-adamantylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|propyl 2-[[2-(1-adamantyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|propyl 2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|PROPYL 2-{[2-(1-ADAMANTYL)ACETYL]AMINO}-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C24H33NO3S |
|---|---|
| Molecular Weight | 415.2181 g/mol |
| LogP | 5.7387 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.2181 |
| Monoisotopic Mass | 415.2181 |
| Heavy Atoms | 29 |
| Complexity | 776.0087 |
Chemical Identifiers
| CAS Number | 445034-75-3 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC34CC5CC(C3)CC(C5)C4 |
Product Overview
AC1N2XD6 (CAS 445034-75-3), with molecular formula C24H33NO3S and molecular weight 415.2181 g/mol. IUPAC: propyl 2-[[2-(1-adamantyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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