4-{[2-(4-chlorophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-2-ethoxyphenyl acetate
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-2-ethoxyphenyl acetate
4-{[2-(4-chlorophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-2-ethoxyphenyl acetate
Compound characteristics
| Compound ID: | 3541-0346 |
| Compound Name: | 4-{[2-(4-chlorophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-2-ethoxyphenyl acetate |
| Molecular Weight: | 441.89 |
| Molecular Formula: | C21 H16 Cl N3 O4 S |
| Smiles: | CCOc1cc(\C=C2/C(n3c(nc(c4ccc(cc4)[Cl])n3)S2)=O)ccc1OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3437 |
| logD: | 4.3437 |
| logSw: | -4.9655 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.244 |
| InChI Key: | NQPMEOZMNQERDI-UHFFFAOYSA-N |