17-(2H-1,3-benzodioxol-5-yl)-1,8-dibromo-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
17-(2H-1,3-benzodioxol-5-yl)-1,8-dibromo-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
17-(2H-1,3-benzodioxol-5-yl)-1,8-dibromo-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: | 8008-9630 |
| Compound Name: | 17-(2H-1,3-benzodioxol-5-yl)-1,8-dibromo-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: | 553.21 |
| Molecular Formula: | C25 H15 Br2 N O4 |
| Smiles: | C1Oc2ccc(cc2O1)N1C(C2C(C1=O)C1(c3ccccc3C2(c2ccccc12)[Br])[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8093 |
| logD: | 4.8093 |
| logSw: | -4.8474 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.565 |
| InChI Key: | MTZSAERXYJUZLO-UHFFFAOYSA-N |