AC1NER7N
9-methyl-10-(4-propan-2-ylphenyl)-8-oxa-10,12-diazatricyclo[7.3.1.02,7]trideca-2,4,6-trien-11-one
Also Known As: 3-(4-isopropylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one|SR-01000123527-1|3-(4-Isopropylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methanobenzo[g][1,3,5]oxadiazocin-4-one|9-methyl-10-(4-propan-2-ylphenyl)-8-oxa-10,12-diazatricyclo[7.3.1.02,7]trideca-2,4,6-trien-11-one|10-(4-isopropylphenyl)-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.02,7]trideca-2,4,6-trien-11-one|2-methyl-3-[4-(propan-2-yl)phenyl]-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
| Molecular Formula | C20H22N2O2 |
|---|---|
| Molecular Weight | 322.16812 g/mol |
| LogP | 4.5796 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.16812 |
| Monoisotopic Mass | 322.16812 |
| Heavy Atoms | 24 |
| Complexity | 784.4808 |
Chemical Identifiers
| CAS Number | 899784-34-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)N2C(=O)NC3CC2(OC4=CC=CC=C34)C |
Product Overview
AC1NER7N (CAS 899784-34-0), with molecular formula C20H22N2O2 and molecular weight 322.16812 g/mol. IUPAC: 9-methyl-10-(4-propan-2-ylphenyl)-8-oxa-10,12-diazatricyclo[7.3.1.02,7]trideca-2,4,6-trien-11-one.