5-(4-chlorophenyl)-2-({3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}methylidene)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
5-(4-chlorophenyl)-2-({3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}methylidene)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
5-(4-chlorophenyl)-2-({3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}methylidene)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | Y501-5592 |
| Compound Name: | 5-(4-chlorophenyl)-2-({3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}methylidene)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 658.12 |
| Molecular Formula: | C35 H26 Cl F2 N3 O4 S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])N2C(=N1)SC(=C\c1ccc(c(COc3ccc(cc3F)F)c1)OC)\C2=O)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9802 |
| logD: | 6.9796 |
| logSw: | -6.4114 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.029 |
| InChI Key: | XKIDIBBYCPEKMX-YTTGMZPUSA-N |