2-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
2-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
2-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | C451-0051 |
| Compound Name: | 2-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C24 H21 N3 O4 S |
| Smiles: | [H]C(=C1/C(N2C(=NC(C(Cc3ccc(C)cc3)=N2)=O)S1)=O)\c1ccc(c(c1)OC)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 3.9184 |
| logD: | 3.9184 |
| logSw: | -3.989 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.687 |
| InChI Key: | HQBJPCRRVZPBPE-UHFFFAOYSA-N |