AC1M0QS8
N',N'-diethyl-N-(7-propan-2-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)propane-1,3-diamine
Also Known As: N,N-diethyl-N'-[4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]propane-1,3-diamine|N1,N1-diethyl-N3-(4-isopropyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)propane-1,3-diamine
| Molecular Formula | C22H31N5S |
|---|---|
| Molecular Weight | 397.23 g/mol |
| LogP | 4.9954 |
| Topological Polar Surface Area | 53.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.23 |
| Monoisotopic Mass | 397.23 |
| Heavy Atoms | 28 |
| Complexity | 974.1175 |
Chemical Identifiers
| CAS Number | 848754-49-4 |
|---|---|
| SMILES | CCN(CC)CCCNC1=NC=NC2=C1SC3=C2C4=C(CCC4)C(=N3)C(C)C |
Product Overview
AC1M0QS8 (CAS 848754-49-4), with molecular formula C22H31N5S and molecular weight 397.23 g/mol. IUPAC: N',N'-diethyl-N-(7-propan-2-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)propane-1,3-diamine.
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