C27H23ClN4OS
9-(3-chlorophenyl)-4-methyl-11-(4-methylphenyl)-14-methylsulfanyl-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-chlorophenyl)-2-methyl-10-(methylthio)-7-(p-tolyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine|6-(3-chlorophenyl)-2-methyl-7-(4-methylphenyl)-10-(methylsulfanyl)-7,11-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
CAS: 877809-59-1
| Molecular Formula | C27H23ClN4OS |
|---|---|
| Molecular Weight | 486.1281 g/mol |
| LogP | 6.83014 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 486.1281 |
| Monoisotopic Mass | 486.1281 |
| Heavy Atoms | 34 |
| Complexity | 1443.523 |
Chemical Identifiers
| CAS Number | 877809-59-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C3=C(C4=C(C=CC(=C4)C)OC3C5=CC(=CC=C5)Cl)NC6=NC(=NN26)SC |
Product Overview
C27H23ClN4OS (CAS 877809-59-1), with molecular formula C27H23ClN4OS and molecular weight 486.1281 g/mol. IUPAC: 9-(3-chlorophenyl)-4-methyl-11-(4-methylphenyl)-14-methylsulfanyl-8-oxa-12,13,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,15-hexaene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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