5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5606-3257 |
| Compound Name: | 5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C23 H24 N4 O3 S |
| Smiles: | CCCCCCOc1ccc(\C=C2/C(n3c(nc(c4cccnc4)n3)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.7504 |
| logD: | 4.6831 |
| logSw: | -4.4829 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.849 |
| InChI Key: | VPMKXSOWKILHJM-UHFFFAOYSA-N |