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]-N-phenylacetamide
Chemical Structure Depiction of
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]-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]-N-phenylacetamide
Compound characteristics
| Compound ID: | 0931-0518 |
| Compound Name: | 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]-N-phenylacetamide |
| Molecular Weight: | 422.48 |
| Molecular Formula: | C27 H22 N2 O3 |
| Smiles: | CC(N(CN1C(C2C(C3c4ccccc4C2c2ccccc23)C1=O)=O)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4763 |
| logD: | 3.4763 |
| logSw: | -3.6127 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.845 |
| InChI Key: | DDTCKOBLSPWXJN-UHFFFAOYSA-N |