AC1MIT2E
N-[(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)methyl]-2,2,2-trifluoro-N-phenylacetamide
Also Known As: ChemDiv1_019369|HMS642A09|RCL R457779|BAS 00341022|AG-205/34704040|SR-01000397242-1|A1263/0057770|N-((12,14-dioxo-11,12,14,15-tetrahydro-9H-9,10-[3,4]epipyrroloanthracen-13(10H)-yl)methyl)-2,2,2-trifluoro-N-phenylacetamide|N-[(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)methyl]-2,2,2-trifluoro-N-phenylacetamide|N-[(16,18-Dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)methyl]-2,2,2-trifluoro-N-phenylacetamide|N-(((9R,10S,11S,15R)-12,14-dioxo-11,12,14,15-tetrahydro-9H-9,10-[3,4]epipyrroloanthracen-13(10H)-yl)methyl)-2,2,2-trifluoro-N-phenylacetamide|N-({16,18-dioxo-17-azapentacyclo[6.6.5.0(2),?.0?,(1)?.0(1)?,(1)?]nonadeca-2,4,6,9(14),10,12-hexaen-17-yl}methyl)-2,2,2-trifluoro-N-phenylacetamide|N-({16,18-dioxo-17-azapentacyclo[6.6.5.0^{2,7}.0^{9,14}.0^{15,19}]nonadeca-2,4,6,9,11,13-hexaen-17-yl}methyl)-2,2,2-trifluoro-N-phenylacetamide|N-[(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)methyl]-2,2,2-trifluoro-N-phenylacetamide (non-preferred name)
| Molecular Formula | C27H19F3N2O3 |
|---|---|
| Molecular Weight | 476.13477 g/mol |
| LogP | 4.4316 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 476.13477 |
| Monoisotopic Mass | 476.13477 |
| Heavy Atoms | 35 |
| Complexity | 1255.8394 |
Chemical Identifiers
| CAS Number | 313259-40-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(CN2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46)C(=O)C(F)(F)F |
Product Overview
AC1MIT2E (CAS 313259-40-4), with molecular formula C27H19F3N2O3 and molecular weight 476.13477 g/mol. IUPAC: N-[(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)methyl]-2,2,2-trifluoro-N-phenylacetamide.
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