SMSSF-0614492
2-[10-(3,5-dimethylphenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl]-5-methoxyphenol
Also Known As: VU0611020-1|F3329-0232|2-(7-(3,5-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-5-methoxyphenol|2-[10-(3,5-dimethylphenyl)-3,5,6,8,10,11-hexaazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2,4,7,11-pentaen-4-yl]-5-methoxyphenol|5-methoxy-2-[6-(3,5-xylyl)-1,3,3a,5,6,7-hexaaza-6H-as-indacen-2-yl]phenol|2-[10-(3,5-dimethylphenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl]-5-methoxyphenol|2-[3-(3,5-dimethylphenyl)(6-hydropyrazolo[5,4-d]1,2,4-triazolo[1,5-e]pyrimidin -8-yl)]-5-methoxyphenol|2-[7-(3,5-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-5-methoxyphenol
| Molecular Formula | C21H18N6O2 |
|---|---|
| Molecular Weight | 386.1491 g/mol |
| LogP | 3.46124 |
| Topological Polar Surface Area | 90.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.1491 |
| Monoisotopic Mass | 386.1491 |
| Heavy Atoms | 29 |
| Complexity | 1364.9886 |
Chemical Identifiers
| CAS Number | 900883-91-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C3=C(C=N2)C4=NC(=NN4C=N3)C5=C(C=C(C=C5)OC)O)C |
Product Overview
SMSSF-0614492 (CAS 900883-91-2), with molecular formula C21H18N6O2 and molecular weight 386.1491 g/mol. IUPAC: 2-[10-(3,5-dimethylphenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl]-5-methoxyphenol.