2-{[3-methoxy-4-(octyloxy)phenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
2-{[3-methoxy-4-(octyloxy)phenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
2-{[3-methoxy-4-(octyloxy)phenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | 5606-3441 |
| Compound Name: | 2-{[3-methoxy-4-(octyloxy)phenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C22 H27 N3 O4 S |
| Smiles: | CCCCCCCCOc1ccc(\C=C2/C(N3C(=NC(C(C)=N3)=O)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.8211 |
| logD: | 4.8211 |
| logSw: | -4.6291 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.228 |
| InChI Key: | LBZCWZZOYILZGY-UHFFFAOYSA-N |