2-(3,4-dimethoxyphenyl)-5-[(3-phenoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-5-[(3-phenoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(3,4-dimethoxyphenyl)-5-[(3-phenoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
Compound ID: | 6187-1962 |
Compound Name: | 2-(3,4-dimethoxyphenyl)-5-[(3-phenoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
Molecular Weight: | 457.51 |
Molecular Formula: | C25 H19 N3 O4 S |
Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(c(c3)OC)OC)n2)S1)=O)\c1cccc(c1)Oc1ccccc1 |
Stereo: | ACHIRAL |
logP: | 5.2925 |
logD: | 5.2925 |
logSw: | -5.4557 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 59.204 |
InChI Key: | VMGPTDJWQYKCEJ-UHFFFAOYSA-N |