2-{[4-(heptyloxy)-3-methoxyphenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
2-{[4-(heptyloxy)-3-methoxyphenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
2-{[4-(heptyloxy)-3-methoxyphenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | 5606-3352 |
| Compound Name: | 2-{[4-(heptyloxy)-3-methoxyphenyl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C21 H25 N3 O4 S |
| Smiles: | CCCCCCCOc1ccc(\C=C2/C(N3C(=NC(C(C)=N3)=O)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.3251 |
| logD: | 4.3251 |
| logSw: | -4.3515 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.228 |
| InChI Key: | HDRPXROCXUVSCZ-UHFFFAOYSA-N |