5-(phenoxymethyl)-4-phenyl-2-(9H-xanthen-9-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(phenoxymethyl)-4-phenyl-2-(9H-xanthen-9-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(phenoxymethyl)-4-phenyl-2-(9H-xanthen-9-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8010-3535 |
| Compound Name: | 5-(phenoxymethyl)-4-phenyl-2-(9H-xanthen-9-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 463.56 |
| Molecular Formula: | C28 H21 N3 O2 S |
| Smiles: | C(C1=NN(C2c3ccccc3Oc3ccccc23)C(N1c1ccccc1)=S)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1525 |
| logD: | 6.1385 |
| logSw: | -6.1342 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.548 |
| InChI Key: | IJZJUAIAIJAYCL-UHFFFAOYSA-N |