AC1NE824
5,5,23-trimethyl-9-morpholin-4-yl-6-oxa-12-thia-10,15,22,24-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),9,14,16,18,20,23-nonaene
Also Known As: 5,5,8-trimethyl-2-(morpholin-4-yl)-5,6-dihydro-3H-pyrano[4''',3''':4'',5'']pyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[1,6-a]benzimidazole|5,5,8-trimethyl-2-morpholino-5,6-dihydro-3H-benzo[4,5]imidazo[1,2-c]pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3-e]pyrimidine
| Molecular Formula | C25H25N5O2S |
|---|---|
| Molecular Weight | 459.17288 g/mol |
| LogP | 4.64172 |
| Topological Polar Surface Area | 64.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 459.17288 |
| Monoisotopic Mass | 459.17288 |
| Heavy Atoms | 33 |
| Complexity | 1578.6775 |
Chemical Identifiers
| CAS Number | 836634-95-8 |
|---|---|
| SMILES | CC1=NC2=C(C3=NC4=CC=CC=C4N13)SC5=C2C6=C(COC(C6)(C)C)C(=N5)N7CCOCC7 |
Product Overview
AC1NE824 (CAS 836634-95-8), with molecular formula C25H25N5O2S and molecular weight 459.17288 g/mol. IUPAC: 5,5,23-trimethyl-9-morpholin-4-yl-6-oxa-12-thia-10,15,22,24-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),9,14,16,18,20,23-nonaene.
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