1-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-phenylpiperazin-1-yl)naphthalen-2-ol
Chemical Structure Depiction of
1-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-phenylpiperazin-1-yl)naphthalen-2-ol
1-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-phenylpiperazin-1-yl)naphthalen-2-ol
Compound characteristics
| Compound ID: | 8019-8921 |
| Compound Name: | 1-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-phenylpiperazin-1-yl)naphthalen-2-ol |
| Molecular Weight: | 494.62 |
| Molecular Formula: | C28 H26 N6 O S |
| Smiles: | Cn1c(c2ccncc2)nnc1Sc1c(cc(c2ccccc12)N1CCN(CC1)c1ccccc1)O |
| Stereo: | ACHIRAL |
| logP: | 4.9779 |
| logD: | 4.9709 |
| logSw: | -4.4656 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.167 |
| InChI Key: | VYVOAGWQAIVEPI-UHFFFAOYSA-N |