N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide
Chemical Structure Depiction of
N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide
N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide
Compound characteristics
| Compound ID: | Y030-8865 |
| Compound Name: | N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C21 H21 N3 O2 S |
| Smiles: | CCC(CC)c1nnc(NC(C2c3ccccc3Oc3ccccc23)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.2109 |
| logD: | -1.7975 |
| logSw: | -5.0997 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.688 |
| InChI Key: | WXBAFMRKYYTXGG-UHFFFAOYSA-N |