N-(5-butyl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide
Chemical Structure Depiction of
N-(5-butyl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide
N-(5-butyl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide
Compound characteristics
| Compound ID: | Y031-0861 |
| Compound Name: | N-(5-butyl-1,3,4-thiadiazol-2-yl)-9H-xanthene-9-carboxamide |
| Molecular Weight: | 365.45 |
| Molecular Formula: | C20 H19 N3 O2 S |
| Smiles: | CCCCc1nnc(NC(C2c3ccccc3Oc3ccccc23)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8833 |
| logD: | -2.125 |
| logSw: | -4.6188 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.183 |
| InChI Key: | UGZOGTSDYYCHJY-UHFFFAOYSA-N |