1-{[5-(3-hydroxypropyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(morpholin-4-yl)naphthalen-2-ol
Chemical Structure Depiction of
1-{[5-(3-hydroxypropyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(morpholin-4-yl)naphthalen-2-ol
1-{[5-(3-hydroxypropyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(morpholin-4-yl)naphthalen-2-ol
Compound characteristics
| Compound ID: | 8019-4043 |
| Compound Name: | 1-{[5-(3-hydroxypropyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-4-(morpholin-4-yl)naphthalen-2-ol |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C25 H26 N4 O3 S |
| Smiles: | C(Cc1nnc(n1c1ccccc1)Sc1c(cc(c2ccccc12)N1CCOCC1)O)CO |
| Stereo: | ACHIRAL |
| logP: | 3.3365 |
| logD: | 3.3221 |
| logSw: | -3.3104 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.952 |
| InChI Key: | VLONWMPOXWRLFZ-UHFFFAOYSA-N |