1-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-methylpiperazin-1-yl)naphthalen-2-ol
Chemical Structure Depiction of
1-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-methylpiperazin-1-yl)naphthalen-2-ol
1-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-methylpiperazin-1-yl)naphthalen-2-ol
Compound characteristics
| Compound ID: | 8019-0145 |
| Compound Name: | 1-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(4-methylpiperazin-1-yl)naphthalen-2-ol |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C22 H23 N5 O2 S |
| Smiles: | CN1CCN(CC1)c1cc(c(c2ccccc12)Sc1nnc(c2ccco2)n1C)O |
| Stereo: | ACHIRAL |
| logP: | 3.3592 |
| logD: | 2.8965 |
| logSw: | -3.3926 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.534 |
| InChI Key: | YSFORVZZBYAVET-UHFFFAOYSA-N |