AC1NKJLG
N-(3-methoxypropyl)-15-methyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide
Also Known As: AO-022/43453344|N-(3-methoxypropyl)-11-methyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide|N-(3-methoxypropyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide|N-(3-Methoxypropyl)-15-methyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide
| Molecular Formula | C17H21N5O2S |
|---|---|
| Molecular Weight | 359.1416 g/mol |
| LogP | 2.5451 |
| Topological Polar Surface Area | 81.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.1416 |
| Monoisotopic Mass | 359.1416 |
| Heavy Atoms | 25 |
| Complexity | 932.049 |
Chemical Identifiers
| CAS Number | 896836-91-2 |
|---|---|
| SMILES | CC1CCCC2=C1C3=C(S2)N=CN4C3=NC(=N4)C(=O)NCCCOC |
Product Overview
AC1NKJLG (CAS 896836-91-2), with molecular formula C17H21N5O2S and molecular weight 359.1416 g/mol. IUPAC: N-(3-methoxypropyl)-15-methyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide.
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