2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-6-[(4-propoxyphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-6-[(4-propoxyphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-6-[(4-propoxyphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
Compound ID: | C451-0234 |
Compound Name: | 2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-6-[(4-propoxyphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
Molecular Weight: | 507.61 |
Molecular Formula: | C27 H29 N3 O5 S |
Smiles: | CCCOc1ccc(CC2C(N=C3N(C(/C(=C\c4ccc(c(c4)OC)OCC(C)C)S3)=O)N=2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.2035 |
logD: | 5.2035 |
logSw: | -5.1101 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 73.186 |
InChI Key: | QQDTZGKHBQNXHU-UHFFFAOYSA-N |