N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
Chemical Structure Depiction of
N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
Compound characteristics
| Compound ID: | Y031-3181 |
| Compound Name: | N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C23 H17 N3 O4 S2 |
| Smiles: | C(c1nnc(NC(C2c3ccccc3Oc3ccccc23)=O)s1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8478 |
| logD: | -3.1606 |
| logSw: | -4.3532 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.948 |
| InChI Key: | JFTRZBZXKGUVML-UHFFFAOYSA-N |