1-acetyl-17-(4-ethoxyphenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Chemical Structure Depiction of
1-acetyl-17-(4-ethoxyphenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
1-acetyl-17-(4-ethoxyphenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Compound characteristics
| Compound ID: | 8006-0509 |
| Compound Name: | 1-acetyl-17-(4-ethoxyphenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C28 H23 N O4 |
| Smiles: | CCOc1ccc(cc1)N1C(C2C3c4ccccc4C(C2C1=O)(C(C)=O)c1ccccc13)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6496 |
| logD: | 3.6495 |
| logSw: | -3.8773 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.4 |
| InChI Key: | KWTVZVHIEDZXNN-UHFFFAOYSA-N |