C19H18N4OS
4-(7,13-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)phenol
Also Known As: 4-(5,9-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol|4-(5,9-dimethyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
CAS: 899414-89-2
| Molecular Formula | C19H18N4OS |
|---|---|
| Molecular Weight | 350.12012 g/mol |
| LogP | 4.14482 |
| Topological Polar Surface Area | 63.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 350.12012 |
| Monoisotopic Mass | 350.12012 |
| Heavy Atoms | 25 |
| Complexity | 1110.3121 |
Chemical Identifiers
| CAS Number | 899414-89-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C4=NC(=NN4C(=N3)C)C5=CC=C(C=C5)O |
Product Overview
C19H18N4OS (CAS 899414-89-2), with molecular formula C19H18N4OS and molecular weight 350.12012 g/mol. IUPAC: 4-(7,13-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)phenol.
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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