5-(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)-2-(morpholin-4-yl)benzoic acid
Chemical Structure Depiction of
5-(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)-2-(morpholin-4-yl)benzoic acid
5-(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)-2-(morpholin-4-yl)benzoic acid
Compound characteristics
| Compound ID: | 8011-5565 |
| Compound Name: | 5-(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)-2-(morpholin-4-yl)benzoic acid |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C29 H24 N2 O5 |
| Smiles: | C1COCCN1c1ccc(cc1C(O)=O)N1C(C2C(C3c4ccccc4C2c2ccccc23)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0952 |
| logD: | 1.0397 |
| logSw: | -3.4045 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.918 |
| InChI Key: | AUUMSPLIEMMDMQ-UHFFFAOYSA-N |