AC1NKOW7
13-tert-butyl-N-[2-(2-hydroxyethoxy)ethyl]-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: 9-(tert-butyl)-N-(2-(2-hydroxyethoxy)ethyl)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide|9-tert-butyl-N-[2-(2-hydroxyethoxy)ethyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
| Molecular Formula | C20H27N5O3S |
|---|---|
| Molecular Weight | 417.18347 g/mol |
| LogP | 2.2287 |
| Topological Polar Surface Area | 101.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.18347 |
| Monoisotopic Mass | 417.18347 |
| Heavy Atoms | 29 |
| Complexity | 1036.2527 |
Chemical Identifiers
| CAS Number | 899402-77-8 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC3=C2C4=NC(=NN4C=N3)C(=O)NCCOCCO |
Product Overview
AC1NKOW7 (CAS 899402-77-8), with molecular formula C20H27N5O3S and molecular weight 417.18347 g/mol. IUPAC: 13-tert-butyl-N-[2-(2-hydroxyethoxy)ethyl]-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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