AC1N82RO
N-(1,3-benzodioxol-5-ylmethyl)-7-cyclohexyl-6-imino-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-1-cyclohexyl-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide|N~3~-(1,3-benzodioxol-5-ylmethyl)-1-cyclohexyl-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide|N-(benzo[d][1,3]dioxol-5-ylmethyl)-1-cyclohexyl-2-imino-10-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C27H27N5O4 |
|---|---|
| Molecular Weight | 485.2063 g/mol |
| LogP | 3.60099 |
| Topological Polar Surface Area | 110.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 485.2063 |
| Monoisotopic Mass | 485.2063 |
| Heavy Atoms | 36 |
| Complexity | 1631.833 |
Chemical Identifiers
| CAS Number | 877802-58-9 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3C4CCCCC4)C(=O)NCC5=CC6=C(C=C5)OCO6 |
Product Overview
AC1N82RO (CAS 877802-58-9), with molecular formula C27H27N5O4 and molecular weight 485.2063 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-7-cyclohexyl-6-imino-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
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