methyl 2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y500-9834 |
| Compound Name: | methyl 2-({4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 629.95 |
| Molecular Formula: | C30 H23 Cl3 N2 O5 S |
| Smiles: | CC1=C(C(c2ccccc2)N2C(=N1)SC(=C/c1ccc(c(COc3c(cc(cc3[Cl])[Cl])[Cl])c1)OC)\C2=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2505 |
| logD: | 7.2505 |
| logSw: | -6.4342 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.199 |
| InChI Key: | DAUMNMXDCIVZEE-SANMLTNESA-N |