2-(4-bromophenyl)-5-[(3,4-diethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-bromophenyl)-5-[(3,4-diethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-bromophenyl)-5-[(3,4-diethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5606-4207 |
| Compound Name: | 2-(4-bromophenyl)-5-[(3,4-diethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 472.36 |
| Molecular Formula: | C21 H18 Br N3 O3 S |
| Smiles: | CCOc1ccc(/C=C2/C(n3c(nc(c4ccc(cc4)[Br])n3)S2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 5.015 |
| logD: | 5.015 |
| logSw: | -4.7393 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.616 |
| InChI Key: | CJDYLBHMNLQTAX-UHFFFAOYSA-N |