1-(dimethoxymethyl)-17-(3,4-dimethylphenyl)-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-(dimethoxymethyl)-17-(3,4-dimethylphenyl)-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-(dimethoxymethyl)-17-(3,4-dimethylphenyl)-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: | 3849-0412 |
| Compound Name: | 1-(dimethoxymethyl)-17-(3,4-dimethylphenyl)-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: | 453.54 |
| Molecular Formula: | C29 H27 N O4 |
| Smiles: | Cc1ccc(cc1C)N1C(C2C3c4ccccc4C(C2C1=O)(C(OC)OC)c1ccccc13)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3081 |
| logD: | 4.3081 |
| logSw: | -4.5029 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.15 |
| InChI Key: | TXUMECRCGLIMCR-UHFFFAOYSA-N |