3-(4-chlorophenoxy)-5-oxo-5H-anthra[1,9-cd][1,2]oxazol-6-yl 4-methoxybenzoate
Chemical Structure Depiction of
3-(4-chlorophenoxy)-5-oxo-5H-anthra[1,9-cd][1,2]oxazol-6-yl 4-methoxybenzoate
3-(4-chlorophenoxy)-5-oxo-5H-anthra[1,9-cd][1,2]oxazol-6-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | IB08-9124 |
| Compound Name: | 3-(4-chlorophenoxy)-5-oxo-5H-anthra[1,9-cd][1,2]oxazol-6-yl 4-methoxybenzoate |
| Molecular Weight: | 497.89 |
| Molecular Formula: | C28 H16 Cl N O6 |
| Smiles: | COc1ccc(cc1)C(=O)Oc1c2C(C=C(c3c2c(c2ccccc12)on3)Oc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.66 |
| logD: | 6.66 |
| logSw: | -7.67 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 121.16 |
| InChI Key: | ZSTSSUGIERYRPX-UHFFFAOYSA-N |