AC1MJ89G
N-(4-butoxyphenyl)-5-methyl-8-oxo-1,13-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-2(7),3,5,9(16)-tetraene-13-carbothioamide
Also Known As: CBDivE_015554|NPD6009|AG-690/33056025|AH-262/32490007|N-(4-butoxyphenyl)-8-methyl-6-oxo-1,2,3a,4,5,6-hexahydro-3H-3,10b-diazaacephenanthrylene-3-carbothioamide|N-(4-butoxyphenyl)-8-methyl-6-oxo-3a,4,5,6-tetrahydro-1H-3,10b-diazaacephenanthrylene-3(2H)-carbothioamide
| Molecular Formula | C26H29N3O2S |
|---|---|
| Molecular Weight | 447.19806 g/mol |
| LogP | 5.18872 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.19806 |
| Monoisotopic Mass | 447.19806 |
| Heavy Atoms | 32 |
| Complexity | 1232.536 |
Chemical Identifiers
| CAS Number | 294667-01-9 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)NC(=S)N2CCN3C4=C(C=C(C=C4)C)C(=O)C5=C3C2CC5 |
Product Overview
AC1MJ89G (CAS 294667-01-9), with molecular formula C26H29N3O2S and molecular weight 447.19806 g/mol. IUPAC: N-(4-butoxyphenyl)-5-methyl-8-oxo-1,13-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-2(7),3,5,9(16)-tetraene-13-carbothioamide.
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