AC1NG4LN
diethyl 8-methyl-4-(3-nitrophenyl)-9-phenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2,7-dicarboxylate
Also Known As: diethyl 8-methyl-1-(3-nitrophenyl)-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate|3,7-DIETHYL 8-METHYL-1-(3-NITROPHENYL)-9-PHENYL-4,6-DITHIA-1,2,9-TRIAZASPIRO[4.4]NONA-2,7-DIENE-3,7-DICARBOXYLATE|diethyl 2-methyl-6-(3-nitrophenyl)-1-phenyl-4,9-dithia-1,6,7-triazaspiro[4.4]nona-2,7-diene-3,8-dicarboxylate
| Molecular Formula | C23H22N4O6S2 |
|---|---|
| Molecular Weight | 514.0981 g/mol |
| LogP | 4.6839 |
| Topological Polar Surface Area | 114.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 514.0981 |
| Monoisotopic Mass | 514.0981 |
| Heavy Atoms | 35 |
| Complexity | 1235.5271 |
Chemical Identifiers
| CAS Number | 670263-91-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2(S1)N(N=C(S2)C(=O)OCC)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C |
Product Overview
AC1NG4LN (CAS 670263-91-9), with molecular formula C23H22N4O6S2 and molecular weight 514.0981 g/mol. IUPAC: diethyl 8-methyl-4-(3-nitrophenyl)-9-phenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2,7-dicarboxylate.
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