AC1MXGD3
2-[(7-butyl-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)-(2-hydroxyethyl)amino]ethanol
Also Known As: 2,2'-((4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)azanediyl)diethanol|2,2'-[(4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)imino]diethanol
CAS: 862116-41-4
| Molecular Formula | C20H26N4O2S |
|---|---|
| Molecular Weight | 386.17764 g/mol |
| LogP | 2.8618 |
| Topological Polar Surface Area | 82.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 386.17764 |
| Monoisotopic Mass | 386.17764 |
| Heavy Atoms | 27 |
| Complexity | 950.1955 |
Chemical Identifiers
| CAS Number | 862116-41-4 |
|---|---|
| SMILES | CCCCC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)N(CCO)CCO |
Product Overview
AC1MXGD3 (CAS 862116-41-4), with molecular formula C20H26N4O2S and molecular weight 386.17764 g/mol. IUPAC: 2-[(7-butyl-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)-(2-hydroxyethyl)amino]ethanol.
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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