N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
Chemical Structure Depiction of
N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
Compound characteristics
| Compound ID: | Y031-0528 |
| Compound Name: | N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C19 H17 N3 O3 S2 |
| Smiles: | COCCSc1nnc(NC(C2c3ccccc3Oc3ccccc23)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8408 |
| logD: | -3.1676 |
| logSw: | -4.1628 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.392 |
| InChI Key: | RAPJXMSJKVHLCE-UHFFFAOYSA-N |