2-{4-[(prop-2-en-1-yl)oxy]phenyl}-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-{4-[(prop-2-en-1-yl)oxy]phenyl}-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-{4-[(prop-2-en-1-yl)oxy]phenyl}-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6672-0516 |
| Compound Name: | 2-{4-[(prop-2-en-1-yl)oxy]phenyl}-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C23 H21 N3 O5 S |
| Smiles: | COc1cc(\C=C2/C(n3c(nc(c4ccc(cc4)OCC=C)n3)S2)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.3734 |
| logD: | 4.3734 |
| logSw: | -4.4099 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.592 |
| InChI Key: | GCIGUQZBIMSAFG-UHFFFAOYSA-N |