17-(3-chloro-2-methylphenyl)-1-methyl-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-(3-chloro-2-methylphenyl)-1-methyl-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-(3-chloro-2-methylphenyl)-1-methyl-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: | 3271-0172 |
| Compound Name: | 17-(3-chloro-2-methylphenyl)-1-methyl-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: | 413.9 |
| Molecular Formula: | C26 H20 Cl N O2 |
| Smiles: | Cc1c(cccc1[Cl])N1C(C2C3c4ccccc4C(C)(C2C1=O)c1ccccc13)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8158 |
| logD: | 4.8158 |
| logSw: | -4.8842 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.1485 |
| InChI Key: | LGMBHOSCGBSFSW-UHFFFAOYSA-N |