AC1MXGNL
1-[2-hydroxypropyl-(7-morpholin-4-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)amino]propan-2-ol
Also Known As: 1,1'-((4-morpholino-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)azanediyl)bis(propan-2-ol)|1,1'-{[4-(morpholin-4-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]imino}dipropan-2-ol
| Molecular Formula | C22H29N5O3S |
|---|---|
| Molecular Weight | 443.1991 g/mol |
| LogP | 2.1328 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 443.1991 |
| Monoisotopic Mass | 443.1991 |
| Heavy Atoms | 31 |
| Complexity | 1083.8701 |
Chemical Identifiers
| CAS Number | 844649-75-8 |
|---|---|
| SMILES | CC(CN(CC(C)O)C1=NC=NC2=C1SC3=C2C4=C(CCC4)C(=N3)N5CCOCC5)O |
Product Overview
AC1MXGNL (CAS 844649-75-8), with molecular formula C22H29N5O3S and molecular weight 443.1991 g/mol. IUPAC: 1-[2-hydroxypropyl-(7-morpholin-4-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)amino]propan-2-ol.
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