AC1LDROR
5-pyridin-4-yl-4-oxa-8-thia-6-azatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Also Known As: ChemDiv1_001332|Oprea1_499018|HMS590M12|AE-848/34090093|SR-01000214502-1|2-(4-pyridinyl)-6,7,8,9-tetrahydro-4H,5H-cyclohepta[4,5]thieno[2,3-d][1,3]oxazin-4-one|2-(4-pyridyl)-5,6,7,8,9-pentahydrocyclohepta[1,2-d]1,3-oxazino[4,5-b]thiophen- 4-one|2-pyridin-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b][1,3]oxazin-4-one|2-(pyridin-4-yl)-6,7,8,9-tetrahydro-4H,5H-cyclohepta[4,5]thieno[2,3-d][1,3]oxazin-4-one
| Molecular Formula | C16H14N2O2S |
|---|---|
| Molecular Weight | 298.0776 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.0776 |
| Monoisotopic Mass | 298.0776 |
| Heavy Atoms | 21 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 309945-58-2 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC3=C2C(=O)OC(=N3)C4=CC=NC=C4 |
| InChIKey | VJUYJIMTTPMGKQ-UHFFFAOYSA-N |
Product Overview
AC1LDROR (CAS 309945-58-2), with molecular formula C16H14N2O2S and molecular weight 298.0776 g/mol. IUPAC: 5-pyridin-4-yl-4-oxa-8-thia-6-azatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one.
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