2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-N,5-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-N,5-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-N,5-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | Y508-6011 |
| Compound Name: | 2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-N,5-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 691.03 |
| Molecular Formula: | C35 H26 Cl3 N3 O4 S |
| Smiles: | CC1=C(C(c2ccccc2)N2C(=N1)SC(=C\c1ccc(c(COc3c(cc(cc3[Cl])[Cl])[Cl])c1)OC)\C2=O)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.1698 |
| logD: | 8.1692 |
| logSw: | -6.5056 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.116 |
| InChI Key: | LAZZSRXESXLROH-HKBQPEDESA-N |