C23H17BrN4OS2
9-(3-bromophenyl)-14-methylsulfanyl-11-thiophen-2-yl-8-oxa-12,13,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,15-hexaene
Also Known As: 6-(3-bromophenyl)-10-(methylsulfanyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine|6-(3-bromophenyl)-10-(methylthio)-7-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C23H17BrN4OS2 |
|---|---|
| Molecular Weight | 508.00272 g/mol |
| LogP | 6.3839 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 508.00272 |
| Monoisotopic Mass | 508.00272 |
| Heavy Atoms | 31 |
| Complexity | 1314.8799 |
Chemical Identifiers
| CAS Number | 877778-18-2 |
|---|---|
| SMILES | CSC1=NN2C(C3=C(C4=CC=CC=C4OC3C5=CC(=CC=C5)Br)NC2=N1)C6=CC=CS6 |
Product Overview
C23H17BrN4OS2 (CAS 877778-18-2), with molecular formula C23H17BrN4OS2 and molecular weight 508.00272 g/mol. IUPAC: 9-(3-bromophenyl)-14-methylsulfanyl-11-thiophen-2-yl-8-oxa-12,13,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,15-hexaene.
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