AC1LR5DK
14-morpholin-4-yl-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,8,13,15(20)-hexaene-6-thione
Also Known As: A3770/0159920|11-morpholino-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3(2H)-thione|11-(Morpholin-4-yl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3(2H)-thione|11-(morpholin-4-yl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3-thiol|11-MORPHOLINO-7,8,9,10-TETRAHYDRO[1,2,4]TRIAZOLO[3'',4'':6',1']PYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-3-YLHYDROSULFIDE|14-Morpholin-4-yl-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,8,13,15(20)-hexaene-6-thione
| Molecular Formula | C18H18N6OS2 |
|---|---|
| Molecular Weight | 398.09836 g/mol |
| LogP | 3.26519 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 398.09836 |
| Monoisotopic Mass | 398.09836 |
| Heavy Atoms | 27 |
| Complexity | 1249.9137 |
Chemical Identifiers
| CAS Number | 489441-19-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N=C2N4CCOCC4)SC5=C3N=CN6C5=NNC6=S |
Product Overview
AC1LR5DK (CAS 489441-19-2), with molecular formula C18H18N6OS2 and molecular weight 398.09836 g/mol. IUPAC: 14-morpholin-4-yl-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,8,13,15(20)-hexaene-6-thione.