N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
Chemical Structure Depiction of
N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide
Compound characteristics
| Compound ID: | 5298-0466 |
| Compound Name: | N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-9H-xanthene-9-carboxamide |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C24 H19 N3 O3 S |
| Smiles: | COc1ccc(Cc2nnc(NC(C3c4ccccc4Oc4ccccc34)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9109 |
| logD: | -2.0974 |
| logSw: | -4.713 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.456 |
| InChI Key: | KQWHQAOLLUYSKV-UHFFFAOYSA-N |