Oprea1_349847
15-(phenoxymethyl)-9-thia-11,13,14,16-tetrazatetracyclo[8.7.0.02,8.013,17]heptadeca-1(10),2(8),11,14,16-pentaene
Also Known As: Oprea1_349847|Oprea1_857925|BAS 03072547|2-(phenoxymethyl)-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine|AE-848/40773422|SR-01000475014-1|15-(phenoxymethyl)-9-thia-11,13,14,16-tetrazatetracyclo[8.7.0.02,8.013,17]heptadeca-1(10),2(8),11,14,16-pentaene
| Molecular Formula | C19H18N4OS |
|---|---|
| Molecular Weight | 350.12012 g/mol |
| LogP | 4.1869 |
| Topological Polar Surface Area | 52.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.12012 |
| Monoisotopic Mass | 350.12012 |
| Heavy Atoms | 25 |
| Complexity | 1037.8849 |
Chemical Identifiers
| CAS Number | 375357-34-9 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC3=C2C4=NC(=NN4C=N3)COC5=CC=CC=C5 |
Product Overview
Oprea1_349847 (CAS 375357-34-9), with molecular formula C19H18N4OS and molecular weight 350.12012 g/mol. IUPAC: 15-(phenoxymethyl)-9-thia-11,13,14,16-tetrazatetracyclo[8.7.0.02,8.013,17]heptadeca-1(10),2(8),11,14,16-pentaene.
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