2-(4-methoxyphenyl)-5-[(2-methyl-2H-1-benzopyran-3-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-5-[(2-methyl-2H-1-benzopyran-3-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-methoxyphenyl)-5-[(2-methyl-2H-1-benzopyran-3-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 4341-1323 |
| Compound Name: | 2-(4-methoxyphenyl)-5-[(2-methyl-2H-1-benzopyran-3-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C22 H17 N3 O3 S |
| Smiles: | CC1C(=Cc2ccccc2O1)/C=C1/C(n2c(nc(c3ccc(cc3)OC)n2)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0261 |
| logD: | 5.0261 |
| logSw: | -4.7117 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.391 |
| InChI Key: | PCERYEQJVYOBBK-ZDUSSCGKSA-N |