AC1LJBKX
13-ethylsulfanyl-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaene
Also Known As: Oprea1_242526|A3912/0166419|8-(ethylsulfanyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine|8-(ETHYLTHIO)-2,2,5-TRIMETHYL-1,4-DIHYDRO-2H-PYRANO[4'',3'':4',5']PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDINE|8-(ethylthio)-2,2,5-trimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C17H19N3OS2 |
|---|---|
| Molecular Weight | 345.09695 g/mol |
| LogP | 4.51122 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 345.09695 |
| Monoisotopic Mass | 345.09695 |
| Heavy Atoms | 23 |
| Complexity | 917.2239 |
Chemical Identifiers
| CAS Number | 672275-42-2 |
|---|---|
| SMILES | CCSC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)C |
Product Overview
AC1LJBKX (CAS 672275-42-2), with molecular formula C17H19N3OS2 and molecular weight 345.09695 g/mol. IUPAC: 13-ethylsulfanyl-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaene.
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