AC1LESW9
4,4,10-trimethyl-5-oxa-8-thia-10,12,13,14,15-pentazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),11,13-tetraen-16-one
Also Known As: ChemDiv1_027272|Oprea1_123625|Oprea1_283827|HMS664H14|BAS 00338294|AE-848/31942020|SR-01000515341-1|A1304/0059280|4,8,8-trimethyl-4,6,8,9-tetrahydro-10H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3,4]tetraazolo[1,5-a]pyrimidin-10-one|4,8,8-trimethyl-4,6,8,9-tetrahydro-10H-pyrano[4',3':4,5]thieno[2,3-d]tetraazolo[1,5-a]pyrimidin-10-one|4,8,8-trimethyl-4,6,8,9-tetrahydro-10H-pyrano[4',3':4,5]thieno[2,3-d]tetrazolo[1,5-a]pyrimidin-10-one|4,8,8-trimethyl-8,9-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]tetrazolo[1,5-a]pyrimidin-10(6H)-one
| Molecular Formula | C12H13N5O2S |
|---|---|
| Molecular Weight | 291.079 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 291.079 |
| Monoisotopic Mass | 291.079 |
| Heavy Atoms | 20 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 294875-15-3 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N4C(=NN=N4)N3C)C |
| InChIKey | ASTURYLVCZATCY-UHFFFAOYSA-N |
Product Overview
AC1LESW9 (CAS 294875-15-3), with molecular formula C12H13N5O2S and molecular weight 291.079 g/mol. IUPAC: 4,4,10-trimethyl-5-oxa-8-thia-10,12,13,14,15-pentazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),11,13-tetraen-16-one.